var bibbase_data = {"data":"<img src=\"//bibbase.org/img/ajax-loader.gif\" id=\"spinner\"\n  style=\"display: none;\" alt=\"Loading..\" />\n\n<div id=\"bibbase\">\n\n  <script type=\"text/javascript\">\n    var bibbase = {\n      params: {\"bib\":\"https://jherasdo.github.io/publications.bib\",\"jsonp\":\"1\",\"host\":\"bibbase.org\",\"ssl\":false},\n      data: [{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Pythonic Chemistry: The Beginner’s Guide to Digital Chemistry\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Garay-Ruiz\"],\"firstnames\":[\"Diego\"],\"suffixes\":[]}],\"journal\":\"Journal of Chemical Education\",\"year\":\"2024\",\"publisher\":\"ACS Publications\",\"url\":\"https://doi.org/10.1021/acs.jchemed.4c00840\",\"bibtex\":\"@article{heras2024pythonic,\\n  title={Pythonic Chemistry: The Beginner’s Guide to Digital Chemistry},\\n  author={Heras-Domingo, Javier and Garay-Ruiz, Diego},\\n  journal={Journal of Chemical Education},\\n  year={2024},\\n  publisher={ACS Publications},\\n  url={https://doi.org/10.1021/acs.jchemed.4c00840},\\n}\\n\\n\",\"author_short\":[\"Heras-Domingo, J.\",\"Garay-Ruiz, D.\"],\"key\":\"heras2024pythonic\",\"id\":\"heras2024pythonic\",\"bibbaseid\":\"herasdomingo-garayruiz-pythonicchemistrythebeginnersguidetodigitalchemistry-2024\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1021/acs.jchemed.4c00840\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":1,\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Pourbaix Machine Learning Framework Identifies Acidic Water Oxidation Catalysts Exhibiting Suppressed Ruthenium Dissolution\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Abed\"],\"firstnames\":[\"Jehad\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Sanspeur\"],\"firstnames\":[\"Rohan\",\"Yuri\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Luo\"],\"firstnames\":[\"Mingchuan\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Alnoush\"],\"firstnames\":[\"Wajdi\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Meira\"],\"firstnames\":[\"Debora\",\"Motta\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Wang\"],\"firstnames\":[\"Hsiaotsu\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Wang\"],\"firstnames\":[\"Jian\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Zhou\"],\"firstnames\":[\"Jigang\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Zhou\"],\"firstnames\":[\"Daojin\"],\"suffixes\":[]},{\"firstnames\":[],\"propositions\":[],\"lastnames\":[\"others\"],\"suffixes\":[]}],\"journal\":\"Journal of the American Chemical Society\",\"year\":\"2024\",\"publisher\":\"ACS Publications\",\"url\":\"https://doi.org/10.1021/jacs.4c01353\",\"bibtex\":\"@article{abed2024pourbaix,\\n  title={Pourbaix Machine Learning Framework Identifies Acidic Water Oxidation Catalysts Exhibiting Suppressed Ruthenium Dissolution},\\n  author={Abed, Jehad and Heras-Domingo, Javier and Sanspeur, Rohan Yuri and Luo, Mingchuan and Alnoush, Wajdi and Meira, Debora Motta and Wang, Hsiaotsu and Wang, Jian and Zhou, Jigang and Zhou, Daojin and others},\\n  journal={Journal of the American Chemical Society},\\n  year={2024},\\n  publisher={ACS Publications},\\n  url={https://doi.org/10.1021/jacs.4c01353},\\n}\\n\\n\",\"author_short\":[\"Abed, J.\",\"Heras-Domingo, J.\",\"Sanspeur, R. Y.\",\"Luo, M.\",\"Alnoush, W.\",\"Meira, D. M.\",\"Wang, H.\",\"Wang, J.\",\"Zhou, J.\",\"Zhou, D.\",\"others\"],\"key\":\"abed2024pourbaix\",\"id\":\"abed2024pourbaix\",\"bibbaseid\":\"abed-herasdomingo-sanspeur-luo-alnoush-meira-wang-wang-etal-pourbaixmachinelearningframeworkidentifiesacidicwateroxidationcatalystsexhibitingsuppressedrutheniumdissolution-2024\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1021/jacs.4c01353\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Quantitative Description of Metal Center Organization and Interactions in Single-Atom Catalysts\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Rossi\"],\"firstnames\":[\"Kevin\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Ruiz-Ferrando\"],\"firstnames\":[\"Andrea\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Akl\"],\"firstnames\":[\"Dario\",\"Faust\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Abalos\"],\"firstnames\":[\"Victor\",\"Gimenez\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Graux\"],\"firstnames\":[\"Romain\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Hai\"],\"firstnames\":[\"Xiao\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Lu\"],\"firstnames\":[\"Jiong\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Garcia-Gasulla\"],\"firstnames\":[\"Dario\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"López\"],\"firstnames\":[\"Nuria\"],\"suffixes\":[]},{\"firstnames\":[],\"propositions\":[],\"lastnames\":[\"others\"],\"suffixes\":[]}],\"journal\":\"Advanced Materials\",\"pages\":\"2307991\",\"year\":\"2024\",\"publisher\":\"Wiley Online Library\",\"url\":\"https://doi.org/10.1002/adma.202307991\",\"bibtex\":\"@article{rossi2023quantitative,\\n  title={Quantitative Description of Metal Center Organization and Interactions in Single-Atom Catalysts},\\n  author={Rossi, Kevin and Ruiz-Ferrando, Andrea and Akl, Dario Faust and Abalos, Victor Gimenez and Heras-Domingo, Javier and Graux, Romain and Hai, Xiao and Lu, Jiong and Garcia-Gasulla, Dario and L{\\\\'o}pez, Nuria and others},\\n  journal={Advanced Materials},\\n  pages={2307991},\\n  year={2024},\\n  publisher={Wiley Online Library},\\n  url={https://doi.org/10.1002/adma.202307991}\\n}\\n\\n\",\"author_short\":[\"Rossi, K.\",\"Ruiz-Ferrando, A.\",\"Akl, D. F.\",\"Abalos, V. G.\",\"Heras-Domingo, J.\",\"Graux, R.\",\"Hai, X.\",\"Lu, J.\",\"Garcia-Gasulla, D.\",\"López, N.\",\"others\"],\"key\":\"rossi2023quantitative\",\"id\":\"rossi2023quantitative\",\"bibbaseid\":\"rossi-ruizferrando-akl-abalos-herasdomingo-graux-hai-lu-etal-quantitativedescriptionofmetalcenterorganizationandinteractionsinsingleatomcatalysts-2024\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1002/adma.202307991\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Applying Large Graph Neural Networks to Predict Transition Metal Complex Energies Using the tmQM_wB97MV Data Set\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Garrison\"],\"firstnames\":[\"Aaron\",\"G\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Kitchin\"],\"firstnames\":[\"John\",\"R\"],\"suffixes\":[]},{\"propositions\":[\"dos\"],\"lastnames\":[\"Passos\",\"Gomes\"],\"firstnames\":[\"Gabriel\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Ulissi\"],\"firstnames\":[\"Zachary\",\"W\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Blau\"],\"firstnames\":[\"Samuel\",\"M\"],\"suffixes\":[]}],\"journal\":\"Journal of Chemical Information and Modeling\",\"year\":\"2023\",\"publisher\":\"ACS Publications\",\"url\":\"https://doi.org/10.1021/acs.jcim.3c01226\",\"bibtex\":\"@article{garrison2023applying,\\n  title={Applying Large Graph Neural Networks to Predict Transition Metal Complex Energies Using the tmQM\\\\_wB97MV Data Set},\\n  author={Garrison, Aaron G and Heras-Domingo, Javier and Kitchin, John R and dos Passos Gomes, Gabriel and Ulissi, Zachary W and Blau, Samuel M},\\n  journal={Journal of Chemical Information and Modeling},\\n  year={2023},\\n  publisher={ACS Publications},\\n  url={https://doi.org/10.1021/acs.jcim.3c01226},\\n}\\n\\n\",\"author_short\":[\"Garrison, A. G\",\"Heras-Domingo, J.\",\"Kitchin, J. R\",\"dos Passos Gomes, G.\",\"Ulissi, Z. W\",\"Blau, S. M\"],\"key\":\"garrison2023applying\",\"id\":\"garrison2023applying\",\"bibbaseid\":\"garrison-herasdomingo-kitchin-dospassosgomes-ulissi-blau-applyinglargegraphneuralnetworkstopredicttransitionmetalcomplexenergiesusingthetmqmwb97mvdataset-2023\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1021/acs.jcim.3c01226\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Ru-based nanoparticles supported in carbon nanotubes for electrocatalytic hydrogen evolution: structural and electronic effects\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Romero\"],\"firstnames\":[\"Nuria\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Fenoll\"],\"firstnames\":[\"Didac\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Gil\"],\"firstnames\":[\"Laia\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Campos\"],\"firstnames\":[\"Sergi\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Creus\"],\"firstnames\":[\"Jordi\"],\"suffixes\":[]},{\"firstnames\":[],\"propositions\":[],\"lastnames\":[\"Martı́, Gerard\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Collière\"],\"firstnames\":[\"Vincent\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Mesa\"],\"firstnames\":[\"Camilo\",\"A\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Gimenez\"],\"firstnames\":[\"Sixto\"],\"suffixes\":[]},{\"firstnames\":[],\"propositions\":[],\"lastnames\":[\"others\"],\"suffixes\":[]}],\"journal\":\"Inorganic Chemistry Frontiers\",\"year\":\"2023\",\"publisher\":\"Royal Society of Chemistry\",\"url\":\"https://doi.org/10.1039/D3QI00698K\",\"bibtex\":\"@article{romero2023ru,\\n  title={Ru-based nanoparticles supported in carbon nanotubes for electrocatalytic hydrogen evolution: structural and electronic effects},\\n  author={Romero, Nuria and Fenoll, Didac and Gil, Laia and Campos, Sergi and Creus, Jordi and Mart{\\\\'\\\\i}, Gerard and Heras-Domingo, Javier and Colli{\\\\`e}re, Vincent and Mesa, Camilo A and Gimenez, Sixto and others},\\n  journal={Inorganic Chemistry Frontiers},\\n  year={2023},\\n  publisher={Royal Society of Chemistry},\\n  url={https://doi.org/10.1039/D3QI00698K}\\n}\\n\\n\",\"author_short\":[\"Romero, N.\",\"Fenoll, D.\",\"Gil, L.\",\"Campos, S.\",\"Creus, J.\",\"Martı́, Gerard\",\"Heras-Domingo, J.\",\"Collière, V.\",\"Mesa, C. A\",\"Gimenez, S.\",\"others\"],\"key\":\"romero2023ru\",\"id\":\"romero2023ru\",\"bibbaseid\":\"romero-fenoll-gil-campos-creus-mart-herasdomingo-collire-etal-rubasednanoparticlessupportedincarbonnanotubesforelectrocatalytichydrogenevolutionstructuralandelectroniceffects-2023\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1039/D3QI00698K\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"WhereWulff: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Sanspeur\"],\"firstnames\":[\"Rohan\",\"Yuri\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Kitchin\"],\"firstnames\":[\"John\",\"R\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Ulissi\"],\"firstnames\":[\"Zachary\"],\"suffixes\":[]}],\"journal\":\"Journal of Chemical Information and Modeling\",\"year\":\"2023\",\"publisher\":\"ACS Publications\",\"url\":\"https://doi.org/10.1021/acs.jcim.3c00142\",\"bibtex\":\"@article{sanspeur2023wherewulff,\\n  title={WhereWulff: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions},\\n  author={Sanspeur, Rohan Yuri and Heras-Domingo, Javier and Kitchin, John R and Ulissi, Zachary},\\n  journal={Journal of Chemical Information and Modeling},\\n  year={2023},\\n  publisher={ACS Publications},\\n  url={https://doi.org/10.1021/acs.jcim.3c00142}\\n}\\n\\n\",\"author_short\":[\"Sanspeur, R. Y.\",\"Heras-Domingo, J.\",\"Kitchin, J. R\",\"Ulissi, Z.\"],\"key\":\"sanspeur2023wherewulff\",\"id\":\"sanspeur2023wherewulff\",\"bibbaseid\":\"sanspeur-herasdomingo-kitchin-ulissi-wherewulffasemiautonomousworkflowforsystematiccatalystsurfacereactivityunderreactionconditions-2023\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1021/acs.jcim.3c00142\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"The Open Catalyst 2022 (OC22) dataset and challenges for oxide electrocatalysts\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Tran\"],\"firstnames\":[\"Richard\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Lan\"],\"firstnames\":[\"Janice\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Shuaibi\"],\"firstnames\":[\"Muhammed\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Wood\"],\"firstnames\":[\"Brandon\",\"M\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Goyal\"],\"firstnames\":[\"Siddharth\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Das\"],\"firstnames\":[\"Abhishek\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Kolluru\"],\"firstnames\":[\"Adeesh\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Rizvi\"],\"firstnames\":[\"Ammar\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Shoghi\"],\"firstnames\":[\"Nima\"],\"suffixes\":[]},{\"firstnames\":[],\"propositions\":[],\"lastnames\":[\"others\"],\"suffixes\":[]}],\"journal\":\"ACS Catalysis\",\"volume\":\"13\",\"number\":\"5\",\"pages\":\"3066–3084\",\"year\":\"2023\",\"publisher\":\"ACS Publications\",\"url\":\"https://doi.org/10.1021/acscatal.2c05426\",\"bibtex\":\"@article{tran2023open,\\n  title={The Open Catalyst 2022 (OC22) dataset and challenges for oxide electrocatalysts},\\n  author={Tran, Richard and Lan, Janice and Shuaibi, Muhammed and Wood, Brandon M and Goyal, Siddharth and Das, Abhishek and Heras-Domingo, Javier and Kolluru, Adeesh and Rizvi, Ammar and Shoghi, Nima and others},\\n  journal={ACS Catalysis},\\n  volume={13},\\n  number={5},\\n  pages={3066--3084},\\n  year={2023},\\n  publisher={ACS Publications},\\n  url={https://doi.org/10.1021/acscatal.2c05426}\\n}\\n\\n\",\"author_short\":[\"Tran, R.\",\"Lan, J.\",\"Shuaibi, M.\",\"Wood, B. M\",\"Goyal, S.\",\"Das, A.\",\"Heras-Domingo, J.\",\"Kolluru, A.\",\"Rizvi, A.\",\"Shoghi, N.\",\"others\"],\"key\":\"tran2023open\",\"id\":\"tran2023open\",\"bibbaseid\":\"tran-lan-shuaibi-wood-goyal-das-herasdomingo-kolluru-etal-theopencatalyst2022oc22datasetandchallengesforoxideelectrocatalysts-2023\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1021/acscatal.2c05426\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Multi-Descriptor Design of Ruthenium Catalysts for Durable Acidic Water Oxidation\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Abed\"],\"firstnames\":[\"Jehad\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Luo\"],\"firstnames\":[\"Mingchuan\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Sanspeur\"],\"firstnames\":[\"Rohan\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Alnoush\"],\"firstnames\":[\"Wajdi\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Meira\"],\"firstnames\":[\"Debora\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Wang\"],\"firstnames\":[\"Hsiao-Tsu\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Wang\"],\"firstnames\":[\"Jian\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Zhou\"],\"firstnames\":[\"Jigang\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Zhou\"],\"firstnames\":[\"Daojin\"],\"suffixes\":[]},{\"firstnames\":[],\"propositions\":[],\"lastnames\":[\"others\"],\"suffixes\":[]}],\"journal\":\"Preprint\",\"year\":\"2023\",\"url\":\"https://doi.org/10.21203/rs.3.rs-2410178/v1\",\"bibtex\":\"@article{abed2023multi,\\n  title={Multi-Descriptor Design of Ruthenium Catalysts for Durable Acidic Water Oxidation},\\n  author={Abed, Jehad and Heras-Domingo, Javier and Luo, Mingchuan and Sanspeur, Rohan and Alnoush, Wajdi and Meira, Debora and Wang, Hsiao-Tsu and Wang, Jian and Zhou, Jigang and Zhou, Daojin and others},\\n  journal={Preprint},\\n  year={2023},\\n  url={https://doi.org/10.21203/rs.3.rs-2410178/v1}\\n}\\n\\n\",\"author_short\":[\"Abed, J.\",\"Heras-Domingo, J.\",\"Luo, M.\",\"Sanspeur, R.\",\"Alnoush, W.\",\"Meira, D.\",\"Wang, H.\",\"Wang, J.\",\"Zhou, J.\",\"Zhou, D.\",\"others\"],\"key\":\"abed2023multi\",\"id\":\"abed2023multi\",\"bibbaseid\":\"abed-herasdomingo-luo-sanspeur-alnoush-meira-wang-wang-etal-multidescriptordesignofrutheniumcatalystsfordurableacidicwateroxidation-2023\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.21203/rs.3.rs-2410178/v1\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":1,\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Importance of the oxyl character on the IrO2 surface dependent catalytic activity for the oxygen evolution reaction\",\"author\":[{\"propositions\":[],\"lastnames\":[\"González\"],\"firstnames\":[\"Danilo\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Sodupe\"],\"firstnames\":[\"Mariona\"],\"suffixes\":[]},{\"firstnames\":[],\"propositions\":[],\"lastnames\":[\"Rodrı́guez-Santiago, Luis\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Solans-Monfort\"],\"firstnames\":[\"Xavier\"],\"suffixes\":[]}],\"journal\":\"Journal of Catalysis\",\"volume\":\"396\",\"pages\":\"192–201\",\"year\":\"2021\",\"publisher\":\"Elsevier\",\"url\":\"https://doi.org/10.1016/j.jcat.2021.02.026\",\"bibtex\":\"@article{gonzalez2021importance,\\n  title={Importance of the oxyl character on the IrO2 surface dependent catalytic activity for the oxygen evolution reaction},\\n  author={Gonz{\\\\'a}lez, Danilo and Heras-Domingo, Javier and Sodupe, Mariona and Rodr{\\\\'\\\\i}guez-Santiago, Luis and Solans-Monfort, Xavier},\\n  journal={Journal of Catalysis},\\n  volume={396},\\n  pages={192--201},\\n  year={2021},\\n  publisher={Elsevier},\\n  url={https://doi.org/10.1016/j.jcat.2021.02.026}\\n}\\n\\n\",\"author_short\":[\"González, D.\",\"Heras-Domingo, J.\",\"Sodupe, M.\",\"Rodrı́guez-Santiago, Luis\",\"Solans-Monfort, X.\"],\"key\":\"gonzalez2021importance\",\"id\":\"gonzalez2021importance\",\"bibbaseid\":\"gonzlez-herasdomingo-sodupe-rodrguezsantiago-solansmonfort-importanceoftheoxylcharacterontheiro2surfacedependentcatalyticactivityfortheoxygenevolutionreaction-2021\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1016/j.jcat.2021.02.026\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Open catalyst 2020 (OC20) dataset and community challenges\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Chanussot\"],\"firstnames\":[\"Lowik\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Das\"],\"firstnames\":[\"Abhishek\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Goyal\"],\"firstnames\":[\"Siddharth\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Lavril\"],\"firstnames\":[\"Thibaut\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Shuaibi\"],\"firstnames\":[\"Muhammed\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Riviere\"],\"firstnames\":[\"Morgane\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Tran\"],\"firstnames\":[\"Kevin\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Ho\"],\"firstnames\":[\"Caleb\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Hu\"],\"firstnames\":[\"Weihua\"],\"suffixes\":[]},{\"firstnames\":[],\"propositions\":[],\"lastnames\":[\"others\"],\"suffixes\":[]}],\"journal\":\"Acs Catalysis\",\"volume\":\"11\",\"number\":\"10\",\"pages\":\"6059–6072\",\"year\":\"2021\",\"publisher\":\"ACS Publications\",\"url\":\"https://doi.org/10.1021/acscatal.0c04525\",\"bibtex\":\"@article{chanussot2021open,\\n  title={Open catalyst 2020 (OC20) dataset and community challenges},\\n  author={Chanussot, Lowik and Das, Abhishek and Goyal, Siddharth and Lavril, Thibaut and Shuaibi, Muhammed and Riviere, Morgane and Tran, Kevin and Heras-Domingo, Javier and Ho, Caleb and Hu, Weihua and others},\\n  journal={Acs Catalysis},\\n  volume={11},\\n  number={10},\\n  pages={6059--6072},\\n  year={2021},\\n  publisher={ACS Publications},\\n  url={https://doi.org/10.1021/acscatal.0c04525}\\n}\\n\\n\",\"author_short\":[\"Chanussot, L.\",\"Das, A.\",\"Goyal, S.\",\"Lavril, T.\",\"Shuaibi, M.\",\"Riviere, M.\",\"Tran, K.\",\"Heras-Domingo, J.\",\"Ho, C.\",\"Hu, W.\",\"others\"],\"key\":\"chanussot2021open\",\"id\":\"chanussot2021open\",\"bibbaseid\":\"chanussot-das-goyal-lavril-shuaibi-riviere-tran-herasdomingo-etal-opencatalyst2020oc20datasetandcommunitychallenges-2021\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://doi.org/10.1021/acscatal.0c04525\"},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":7,\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"An Introduction to Electrocatalyst Design using Machine Learning for Renewable Energy Storage\",\"author\":[{\"firstnames\":[\"C.\",\"L.\"],\"propositions\":[],\"lastnames\":[\"Zitnick\"],\"suffixes\":[]},{\"firstnames\":[\"L.\"],\"propositions\":[],\"lastnames\":[\"Chanussot\"],\"suffixes\":[]},{\"firstnames\":[\"Abhishek\"],\"propositions\":[],\"lastnames\":[\"Das\"],\"suffixes\":[]},{\"firstnames\":[\"Siddharth\"],\"propositions\":[],\"lastnames\":[\"Goyal\"],\"suffixes\":[]},{\"firstnames\":[\"J.\"],\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"suffixes\":[]},{\"firstnames\":[\"Caleb\"],\"propositions\":[],\"lastnames\":[\"Ho\"],\"suffixes\":[]},{\"firstnames\":[\"Weihua\"],\"propositions\":[],\"lastnames\":[\"Hu\"],\"suffixes\":[]},{\"firstnames\":[\"Thibaut\"],\"propositions\":[],\"lastnames\":[\"Lavril\"],\"suffixes\":[]},{\"firstnames\":[\"Aini\"],\"propositions\":[],\"lastnames\":[\"Palizhati\"],\"suffixes\":[]},{\"firstnames\":[\"M.\"],\"propositions\":[],\"lastnames\":[\"Rivière\"],\"suffixes\":[]},{\"firstnames\":[\"Muhammed\"],\"propositions\":[],\"lastnames\":[\"Shuaibi\"],\"suffixes\":[]},{\"firstnames\":[\"Anuroop\"],\"propositions\":[],\"lastnames\":[\"Sriram\"],\"suffixes\":[]},{\"firstnames\":[\"K.\"],\"propositions\":[],\"lastnames\":[\"Tran\"],\"suffixes\":[]},{\"firstnames\":[\"B.\"],\"propositions\":[],\"lastnames\":[\"Wood\"],\"suffixes\":[]},{\"firstnames\":[\"J.\"],\"propositions\":[],\"lastnames\":[\"Yoon\"],\"suffixes\":[]},{\"firstnames\":[\"D.\"],\"propositions\":[],\"lastnames\":[\"Parikh\"],\"suffixes\":[]},{\"firstnames\":[\"Zachary\"],\"propositions\":[],\"lastnames\":[\"Ulissi\"],\"suffixes\":[]}],\"journal\":\"ArXiv\",\"year\":\"2020\",\"volume\":\"abs/2010.09435\",\"url\":\"https://arxiv.org/abs/2010.09435\",\"bibtex\":\"@article{Zitnick2020AnIT,\\n  title={An Introduction to Electrocatalyst Design using Machine Learning for Renewable Energy Storage},\\n  author={C. L. Zitnick and L. Chanussot and Abhishek Das and Siddharth Goyal and J. Heras-Domingo and Caleb Ho and Weihua Hu and Thibaut Lavril and Aini Palizhati and M. Rivi{\\\\`e}re and Muhammed Shuaibi and Anuroop Sriram and K. Tran and B. Wood and J. Yoon and D. Parikh and Zachary Ulissi},\\n  journal={ArXiv},\\n  year={2020},\\n  volume={abs/2010.09435},\\n  url={https://arxiv.org/abs/2010.09435}\\n}\\n\\n\",\"author_short\":[\"Zitnick, C. L.\",\"Chanussot, L.\",\"Das, A.\",\"Goyal, S.\",\"Heras-Domingo, J.\",\"Ho, C.\",\"Hu, W.\",\"Lavril, T.\",\"Palizhati, A.\",\"Rivière, M.\",\"Shuaibi, M.\",\"Sriram, A.\",\"Tran, K.\",\"Wood, B.\",\"Yoon, J.\",\"Parikh, D.\",\"Ulissi, Z.\"],\"key\":\"Zitnick2020AnIT\",\"id\":\"Zitnick2020AnIT\",\"bibbaseid\":\"zitnick-chanussot-das-goyal-herasdomingo-ho-hu-lavril-etal-anintroductiontoelectrocatalystdesignusingmachinelearningforrenewableenergystorage-2020\",\"role\":\"author\",\"urls\":{\"Paper\":\"https://arxiv.org/abs/2010.09435\"},\"metadata\":{\"authorlinks\":{\"ulissi, z\":\"https://ulissigroup.cheme.cmu.edu/publications/\",\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":1,\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Atomically Dispersed Iridium on Indium Tin Oxide Efficiently Catalyzes Water Oxidation\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Lebedev\"],\"firstnames\":[\"Dmitry\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Ezhov\"],\"firstnames\":[\"Roman\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Comas-Vives\"],\"firstnames\":[\"Aleix\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Kaeffer\"],\"firstnames\":[\"Nicolas\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Willinger\"],\"firstnames\":[\"Marc\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Solans-Monfort\"],\"firstnames\":[\"Xavier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Huang\"],\"firstnames\":[\"Xing\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Pushkar\"],\"firstnames\":[\"Yulia\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Copéret\"],\"firstnames\":[\"Christophe\"],\"suffixes\":[]}],\"journal\":\"ACS central science\",\"volume\":\"6\",\"number\":\"7\",\"pages\":\"1189–1198\",\"year\":\"2020\",\"publisher\":\"ACS Publications\",\"doi\":\"10.1021/acscentsci.0c00604\",\"bibtex\":\"@article{lebedev2020atomically,\\n  title={Atomically Dispersed Iridium on Indium Tin Oxide Efficiently Catalyzes Water Oxidation},\\n  author={Lebedev, Dmitry and Ezhov, Roman and Heras-Domingo, Javier and Comas-Vives, Aleix and Kaeffer, Nicolas and Willinger, Marc and Solans-Monfort, Xavier and Huang, Xing and Pushkar, Yulia and Cop{\\\\'e}ret, Christophe},\\n  journal={ACS central science},\\n  volume={6},\\n  number={7},\\n  pages={1189--1198},\\n  year={2020},\\n  publisher={ACS Publications},\\n  doi={10.1021/acscentsci.0c00604}\\n}\\n\\n\",\"author_short\":[\"Lebedev, D.\",\"Ezhov, R.\",\"Heras-Domingo, J.\",\"Comas-Vives, A.\",\"Kaeffer, N.\",\"Willinger, M.\",\"Solans-Monfort, X.\",\"Huang, X.\",\"Pushkar, Y.\",\"Copéret, C.\"],\"key\":\"lebedev2020atomically\",\"id\":\"lebedev2020atomically\",\"bibbaseid\":\"lebedev-ezhov-herasdomingo-comasvives-kaeffer-willinger-solansmonfort-huang-etal-atomicallydispersediridiumonindiumtinoxideefficientlycatalyzeswateroxidation-2020\",\"role\":\"author\",\"urls\":{},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":0,\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"author\":[{\"propositions\":[],\"lastnames\":[\"González\"],\"firstnames\":[\"Danilo\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Camino\"],\"firstnames\":[\"Bruno\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Rimola\"],\"firstnames\":[\"Albert\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Rodríguez-Santiago\"],\"firstnames\":[\"Luis\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Solans-Monfort\"],\"firstnames\":[\"Xavier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Sodupe\"],\"firstnames\":[\"Mariona\"],\"suffixes\":[]}],\"title\":\"BCN-M: A Free Computational Tool for Generating Wulff-like Nanoparticle Models with Controlled Stoichiometry\",\"journal\":\"The Journal of Physical Chemistry C\",\"volume\":\"124\",\"number\":\"1\",\"pages\":\"1227-1237\",\"year\":\"2020\",\"doi\":\"10.1021/acs.jpcc.9b10506\",\"bibtex\":\"@article{doi:10.1021/acs.jpcc.9b10506,\\nauthor = {González, Danilo and Camino, Bruno and Heras-Domingo, Javier and Rimola, Albert and Rodríguez-Santiago, Luis and Solans-Monfort, Xavier and Sodupe, Mariona},\\ntitle = {BCN-M: A Free Computational Tool for Generating Wulff-like Nanoparticle Models with Controlled Stoichiometry},\\njournal = {The Journal of Physical Chemistry C},\\nvolume = {124},\\nnumber = {1},\\npages = {1227-1237},\\nyear = {2020},\\ndoi = {10.1021/acs.jpcc.9b10506}\\n}\\n\\n\",\"author_short\":[\"González, D.\",\"Camino, B.\",\"Heras-Domingo, J.\",\"Rimola, A.\",\"Rodríguez-Santiago, L.\",\"Solans-Monfort, X.\",\"Sodupe, M.\"],\"key\":\"doi:10.1021/acs.jpcc.9b10506\",\"id\":\"doi:10.1021/acs.jpcc.9b10506\",\"bibbaseid\":\"gonzlez-camino-herasdomingo-rimola-rodrguezsantiago-solansmonfort-sodupe-bcnmafreecomputationaltoolforgeneratingwulfflikenanoparticlemodelswithcontrolledstoichiometry-2020\",\"role\":\"author\",\"urls\":{},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":0,\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Switching acidic and basic catalysis through supramolecular functionalization in a porous 3D covalent imine-based material\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Luis-Barrerra\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Cano\"],\"firstnames\":[\"Rafael\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Imani-Shakibaei\"],\"firstnames\":[\"Ghazaleh\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Pérez-Carvajal\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Imaz\"],\"firstnames\":[\"Inhar\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Maspoch\"],\"firstnames\":[\"Daniel\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Solans-Monfort\"],\"firstnames\":[\"Xavier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Alemán\"],\"firstnames\":[\"José\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Mas-Ballesté\"],\"firstnames\":[\"Rubén\"],\"suffixes\":[]}],\"journal\":\"Catalysis Science & Technology\",\"volume\":\"9\",\"number\":\"21\",\"pages\":\"6007–6014\",\"year\":\"2019\",\"publisher\":\"Royal Society of Chemistry\",\"doi\":\"10.1039/C9CY01527B\",\"bibtex\":\"@article{luis2019switching,\\n  title={Switching acidic and basic catalysis through supramolecular functionalization in a porous 3D covalent imine-based material},\\n  author={Luis-Barrerra, Javier and Cano, Rafael and Imani-Shakibaei, Ghazaleh and Heras-Domingo, Javier and P{\\\\'e}rez-Carvajal, Javier and Imaz, Inhar and Maspoch, Daniel and Solans-Monfort, Xavier and Alem{\\\\'a}n, Jos{\\\\'e} and Mas-Ballest{\\\\'e}, Rub{\\\\'e}n},\\n  journal={Catalysis Science \\\\& Technology},\\n  volume={9},\\n  number={21},\\n  pages={6007--6014},\\n  year={2019},\\n  publisher={Royal Society of Chemistry},\\n  doi={10.1039/C9CY01527B}\\n}\\n\\n\",\"author_short\":[\"Luis-Barrerra, J.\",\"Cano, R.\",\"Imani-Shakibaei, G.\",\"Heras-Domingo, J.\",\"Pérez-Carvajal, J.\",\"Imaz, I.\",\"Maspoch, D.\",\"Solans-Monfort, X.\",\"Alemán, J.\",\"Mas-Ballesté, R.\"],\"key\":\"luis2019switching\",\"id\":\"luis2019switching\",\"bibbaseid\":\"luisbarrerra-cano-imanishakibaei-herasdomingo-prezcarvajal-imaz-maspoch-solansmonfort-etal-switchingacidicandbasiccatalysisthroughsupramolecularfunctionalizationinaporous3dcovalentiminebasedmaterial-2019\",\"role\":\"author\",\"urls\":{},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":0,\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Water Adsorption on MO2 (M= Ti, Ru, and Ir) Surfaces. Importance of Octahedral Distortion and Cooperative Effects\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Gonzalez\"],\"firstnames\":[\"Danilo\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Pantaleone\"],\"firstnames\":[\"Stefano\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Rimola\"],\"firstnames\":[\"Albert\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Rodriguez-Santiago\"],\"firstnames\":[\"Luis\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Solans-Monfort\"],\"firstnames\":[\"Xavier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Sodupe\"],\"firstnames\":[\"Mariona\"],\"suffixes\":[]}],\"journal\":\"ACS omega\",\"volume\":\"4\",\"number\":\"2\",\"pages\":\"2989–2999\",\"year\":\"2019\",\"publisher\":\"ACS Publications\",\"doi\":\"10.1021/acsomega.8b03350\",\"bibtex\":\"@article{gonzalez2019water,\\n  title={Water Adsorption on MO2 (M= Ti, Ru, and Ir) Surfaces. Importance of Octahedral Distortion and Cooperative Effects},\\n  author={Gonzalez, Danilo and Heras-Domingo, Javier and Pantaleone, Stefano and Rimola, Albert and Rodriguez-Santiago, Luis and Solans-Monfort, Xavier and Sodupe, Mariona},\\n  journal={ACS omega},\\n  volume={4},\\n  number={2},\\n  pages={2989--2999},\\n  year={2019},\\n  publisher={ACS Publications},\\n  doi={10.1021/acsomega.8b03350}\\n}\\n\\n\",\"author_short\":[\"Gonzalez, D.\",\"Heras-Domingo, J.\",\"Pantaleone, S.\",\"Rimola, A.\",\"Rodriguez-Santiago, L.\",\"Solans-Monfort, X.\",\"Sodupe, M.\"],\"key\":\"gonzalez2019water\",\"id\":\"gonzalez2019water\",\"bibbaseid\":\"gonzalez-herasdomingo-pantaleone-rimola-rodriguezsantiago-solansmonfort-sodupe-wateradsorptiononmo2mtiruandirsurfacesimportanceofoctahedraldistortionandcooperativeeffects-2019\",\"role\":\"author\",\"urls\":{},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":0,\"html\":\"\"},{\"bibtype\":\"article\",\"type\":\"article\",\"title\":\"Interaction between ruthenium oxide surfaces and water molecules. Effect of surface morphology and water coverage\",\"author\":[{\"propositions\":[],\"lastnames\":[\"Heras-Domingo\"],\"firstnames\":[\"Javier\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Sodupe\"],\"firstnames\":[\"Mariona\"],\"suffixes\":[]},{\"propositions\":[],\"lastnames\":[\"Solans-Monfort\"],\"firstnames\":[\"Xavier\"],\"suffixes\":[]}],\"journal\":\"The Journal of Physical Chemistry C\",\"volume\":\"123\",\"number\":\"13\",\"pages\":\"7786–7798\",\"year\":\"2018\",\"publisher\":\"ACS Publications\",\"doi\":\"10.1021/acs.jpcc.8b06438\",\"bibtex\":\"@article{heras2018interaction,\\n  title={Interaction between ruthenium oxide surfaces and water molecules. Effect of surface morphology and water coverage},\\n  author={Heras-Domingo, Javier and Sodupe, Mariona and Solans-Monfort, Xavier},\\n  journal={The Journal of Physical Chemistry C},\\n  volume={123},\\n  number={13},\\n  pages={7786--7798},\\n  year={2018},\\n  publisher={ACS Publications},\\n  doi={10.1021/acs.jpcc.8b06438}\\n}\\n\",\"author_short\":[\"Heras-Domingo, J.\",\"Sodupe, M.\",\"Solans-Monfort, X.\"],\"key\":\"heras2018interaction\",\"id\":\"heras2018interaction\",\"bibbaseid\":\"herasdomingo-sodupe-solansmonfort-interactionbetweenrutheniumoxidesurfacesandwatermoleculeseffectofsurfacemorphologyandwatercoverage-2018\",\"role\":\"author\",\"urls\":{},\"metadata\":{\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\"downloads\":0,\"html\":\"\"}],\n      metadata: {\"owner\":\"heras-domingo, j\",\"authorlinks\":{\"heras-domingo, j\":\"https://jherasdo.github.io/publications/\"}},\n      ownerID: \"gpt3kGzgzmQAnXC26\"\n    };\n  </script>\n\n  <script type=\"text/javascript\">\n  var site$;\n  if (typeof $ != 'undefined') {\n    console.log('existing jquery: storing and then restoring');\n    site$ = $;\n    $ = null;\n  }\n  </script>\n\n  <script src=\"https://ajax.googleapis.com/ajax/libs/jquery/2.2.4/jquery.min.js\">\n  </script>\n  <script type=\"text/javascript\">\n  if (site$) {\n    console.log('existing jquery: avoiding conflict and restoring');\n    bb$ = $.noConflict(true);\n    $ = site$;\n  } else {\n    bb$ = $;\n  }\n  </script>\n\n  <script src=\"//bibbase.org/js/bibbase.min.js\"\n          type=\"text/javascript\">\n  </script>\n\n  <script type=\"text/javascript\"\n          src=\"https://cdnjs.cloudflare.com/ajax/libs/mathjax/2.7.1/MathJax.js?config=TeX-AMS-MML_HTMLorMML\">\n  </script>\n  <script type=\"text/x-mathjax-config\">\n    MathJax.Hub.Config({tex2jax: {inlineMath: [['$','$'], ['\\\\(','\\\\)']]},\n                        skipTags: [\"body\"],\n                        processClass: \"bibbase_paper\"});\n  </script>\n\n  <style>\n  @media print {\n    .dontprint {\n        display: none !important;\n    }\n\n  .bibbase_group {\n    background-color: #E0E0E0;\n    font-style: italic;\n    font-size: larger;\n    text-shadow: 0px 0px 3px #FFFFFF;\n    border-radius: 4px 4px 4px 4px;\n    -moz-border-radius: 4px 4px 4px 4px;\n    -webkit-border-radius: 4px;\n    padding: 5px 40px 5px;\n    margin-top: 10px;\n    margin-bottom: 5px;\n    cursor: pointer;\n  }\n\n  .bibbase_paper {\n    margin-bottom: 5px;\n  }\n\n  }\n  </style>\n\n  \n  <div style=\"float: right; margin-right: 10px; margin-top: 10px; text-align: right; font-size: 12px\">\n    generated by\n    <a href=\"//bibbase.org\"\n       onclick=\"trackOutboundLink('bibbase', 'logo clicked', window.location.href, '//bibbase.org'); return false;\">\n      <img src=\"//bibbase.org/img/logo.svg\"\n           style=\"vertical-align: middle; margin-left: 3px; height: 16px;\"/\n           alt=\"bibbase.org\"\n           title=\"BibBase – The easiest way to maintain your publications page.\"\n        ></a>\n    \n  </div>\n  \n\n  <div id=\"bibbase_header\" class=\"dontprint\" style=\"\">\n\n    <ul class=\"nav nav-pills\" style=\"margin: 0px;\">\n\n      <li class=\"dropdown\" id=\"groupby_dropdown\">\n      <a class=\"dropdown-toggle\"\n         data-toggle=\"dropdown\"\n         href=\"#\">\n          Group by\n          <b class=\"caret\"></b>\n      </a>\n      <ul class=\"dropdown-menu\">\n        <li class=\"groupby year\"><a onclick=\"groupby('year')\">\n            Year</a>\n        </li>\n        <li class=\"groupby author\"><a onclick=\"groupby('author_short')\">\n            Author</a>\n        </li>\n        <li class=\"groupby type\"><a onclick=\"groupby('type')\">\n            Type</a>\n        </li>\n        <li class=\"groupby keyword\"><a onclick=\"groupby('keyword')\">\n            Keyword</a>\n        </li>\n        <li class=\"groupby downloads\"><a onclick=\"groupby('downloads')\">\n            Downloads</a>\n        </li>\n      </ul>\n      </li>\n\n\n      <li class=\"dropdown\" id=\"menu_dropdown\">\n      <a class=\"dropdown-toggle\"\n         data-toggle=\"dropdown\"\n         href=\"#\" alt=\"controls\">\n          <i class=\"fa fa-reorder\" alt=\"controls\"></i>\n          <b class=\"caret\"></b>\n      </a>\n      <ul class=\"dropdown-menu\">\n        <li>\n          <a onclick=\"toggleAll()\">\n            <i class=\"fa fa-chevron-down fa-fw\"></i> Expand/Collapse All\n          </a>\n        </li>\n        <li>\n          <a download=\"publications.bib\" href=\"data:text/bibtex;base64,@article{heras2024pythonic,
  title={Pythonic Chemistry: The Beginner’s Guide to Digital Chemistry},
  author={Heras-Domingo, Javier and Garay-Ruiz, Diego},
  journal={Journal of Chemical Education},
  year={2024},
  publisher={ACS Publications},
  url={https://doi.org/10.1021/acs.jchemed.4c00840},
}



@article{abed2024pourbaix,
  title={Pourbaix Machine Learning Framework Identifies Acidic Water Oxidation Catalysts Exhibiting Suppressed Ruthenium Dissolution},
  author={Abed, Jehad and Heras-Domingo, Javier and Sanspeur, Rohan Yuri and Luo, Mingchuan and Alnoush, Wajdi and Meira, Debora Motta and Wang, Hsiaotsu and Wang, Jian and Zhou, Jigang and Zhou, Daojin and others},
  journal={Journal of the American Chemical Society},
  year={2024},
  publisher={ACS Publications},
  url={https://doi.org/10.1021/jacs.4c01353},
}



@article{rossi2023quantitative,
  title={Quantitative Description of Metal Center Organization and Interactions in Single-Atom Catalysts},
  author={Rossi, Kevin and Ruiz-Ferrando, Andrea and Akl, Dario Faust and Abalos, Victor Gimenez and Heras-Domingo, Javier and Graux, Romain and Hai, Xiao and Lu, Jiong and Garcia-Gasulla, Dario and L{\'o}pez, Nuria and others},
  journal={Advanced Materials},
  pages={2307991},
  year={2024},
  publisher={Wiley Online Library},
  url={https://doi.org/10.1002/adma.202307991}
}



@article{garrison2023applying,
  title={Applying Large Graph Neural Networks to Predict Transition Metal Complex Energies Using the tmQM\_wB97MV Data Set},
  author={Garrison, Aaron G and Heras-Domingo, Javier and Kitchin, John R and dos Passos Gomes, Gabriel and Ulissi, Zachary W and Blau, Samuel M},
  journal={Journal of Chemical Information and Modeling},
  year={2023},
  publisher={ACS Publications},
  url={https://doi.org/10.1021/acs.jcim.3c01226},
}



@article{romero2023ru,
  title={Ru-based nanoparticles supported in carbon nanotubes for electrocatalytic hydrogen evolution: structural and electronic effects},
  author={Romero, Nuria and Fenoll, Didac and Gil, Laia and Campos, Sergi and Creus, Jordi and Mart{\'\i}, Gerard and Heras-Domingo, Javier and Colli{\`e}re, Vincent and Mesa, Camilo A and Gimenez, Sixto and others},
  journal={Inorganic Chemistry Frontiers},
  year={2023},
  publisher={Royal Society of Chemistry},
  url={https://doi.org/10.1039/D3QI00698K}
}



@article{sanspeur2023wherewulff,
  title={WhereWulff: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions},
  author={Sanspeur, Rohan Yuri and Heras-Domingo, Javier and Kitchin, John R and Ulissi, Zachary},
  journal={Journal of Chemical Information and Modeling},
  year={2023},
  publisher={ACS Publications},
  url={https://doi.org/10.1021/acs.jcim.3c00142}
}



@article{tran2023open,
  title={The Open Catalyst 2022 (OC22) dataset and challenges for oxide electrocatalysts},
  author={Tran, Richard and Lan, Janice and Shuaibi, Muhammed and Wood, Brandon M and Goyal, Siddharth and Das, Abhishek and Heras-Domingo, Javier and Kolluru, Adeesh and Rizvi, Ammar and Shoghi, Nima and others},
  journal={ACS Catalysis},
  volume={13},
  number={5},
  pages={3066--3084},
  year={2023},
  publisher={ACS Publications},
  url={https://doi.org/10.1021/acscatal.2c05426}
}



@article{abed2023multi,
  title={Multi-Descriptor Design of Ruthenium Catalysts for Durable Acidic Water Oxidation},
  author={Abed, Jehad and Heras-Domingo, Javier and Luo, Mingchuan and Sanspeur, Rohan and Alnoush, Wajdi and Meira, Debora and Wang, Hsiao-Tsu and Wang, Jian and Zhou, Jigang and Zhou, Daojin and others},
  journal={Preprint},
  year={2023},
  url={https://doi.org/10.21203/rs.3.rs-2410178/v1}
}



@article{gonzalez2021importance,
  title={Importance of the oxyl character on the IrO2 surface dependent catalytic activity for the oxygen evolution reaction},
  author={Gonz{\'a}lez, Danilo and Heras-Domingo, Javier and Sodupe, Mariona and Rodr{\'\i}guez-Santiago, Luis and Solans-Monfort, Xavier},
  journal={Journal of Catalysis},
  volume={396},
  pages={192--201},
  year={2021},
  publisher={Elsevier},
  url={https://doi.org/10.1016/j.jcat.2021.02.026}
}



@article{chanussot2021open,
  title={Open catalyst 2020 (OC20) dataset and community challenges},
  author={Chanussot, Lowik and Das, Abhishek and Goyal, Siddharth and Lavril, Thibaut and Shuaibi, Muhammed and Riviere, Morgane and Tran, Kevin and Heras-Domingo, Javier and Ho, Caleb and Hu, Weihua and others},
  journal={Acs Catalysis},
  volume={11},
  number={10},
  pages={6059--6072},
  year={2021},
  publisher={ACS Publications},
  url={https://doi.org/10.1021/acscatal.0c04525}
}



@article{Zitnick2020AnIT,
  title={An Introduction to Electrocatalyst Design using Machine Learning for Renewable Energy Storage},
  author={C. L. Zitnick and L. Chanussot and Abhishek Das and Siddharth Goyal and J. Heras-Domingo and Caleb Ho and Weihua Hu and Thibaut Lavril and Aini Palizhati and M. Rivi{\`e}re and Muhammed Shuaibi and Anuroop Sriram and K. Tran and B. Wood and J. Yoon and D. Parikh and Zachary Ulissi},
  journal={ArXiv},
  year={2020},
  volume={abs/2010.09435},
  url={https://arxiv.org/abs/2010.09435}
}



@article{lebedev2020atomically,
  title={Atomically Dispersed Iridium on Indium Tin Oxide Efficiently Catalyzes Water Oxidation},
  author={Lebedev, Dmitry and Ezhov, Roman and Heras-Domingo, Javier and Comas-Vives, Aleix and Kaeffer, Nicolas and Willinger, Marc and Solans-Monfort, Xavier and Huang, Xing and Pushkar, Yulia and Cop{\'e}ret, Christophe},
  journal={ACS central science},
  volume={6},
  number={7},
  pages={1189--1198},
  year={2020},
  publisher={ACS Publications},
  doi={10.1021/acscentsci.0c00604}
}



@article{doi:10.1021/acs.jpcc.9b10506,
author = {González, Danilo and Camino, Bruno and Heras-Domingo, Javier and Rimola, Albert and Rodríguez-Santiago, Luis and Solans-Monfort, Xavier and Sodupe, Mariona},
title = {BCN-M: A Free Computational Tool for Generating Wulff-like Nanoparticle Models with Controlled Stoichiometry},
journal = {The Journal of Physical Chemistry C},
volume = {124},
number = {1},
pages = {1227-1237},
year = {2020},
doi = {10.1021/acs.jpcc.9b10506}
}



@article{luis2019switching,
  title={Switching acidic and basic catalysis through supramolecular functionalization in a porous 3D covalent imine-based material},
  author={Luis-Barrerra, Javier and Cano, Rafael and Imani-Shakibaei, Ghazaleh and Heras-Domingo, Javier and P{\'e}rez-Carvajal, Javier and Imaz, Inhar and Maspoch, Daniel and Solans-Monfort, Xavier and Alem{\'a}n, Jos{\'e} and Mas-Ballest{\'e}, Rub{\'e}n},
  journal={Catalysis Science \& Technology},
  volume={9},
  number={21},
  pages={6007--6014},
  year={2019},
  publisher={Royal Society of Chemistry},
  doi={10.1039/C9CY01527B}
}



@article{gonzalez2019water,
  title={Water Adsorption on MO2 (M= Ti, Ru, and Ir) Surfaces. Importance of Octahedral Distortion and Cooperative Effects},
  author={Gonzalez, Danilo and Heras-Domingo, Javier and Pantaleone, Stefano and Rimola, Albert and Rodriguez-Santiago, Luis and Solans-Monfort, Xavier and Sodupe, Mariona},
  journal={ACS omega},
  volume={4},
  number={2},
  pages={2989--2999},
  year={2019},
  publisher={ACS Publications},
  doi={10.1021/acsomega.8b03350}
}



@article{heras2018interaction,
  title={Interaction between ruthenium oxide surfaces and water molecules. Effect of surface morphology and water coverage},
  author={Heras-Domingo, Javier and Sodupe, Mariona and Solans-Monfort, Xavier},
  journal={The Journal of Physical Chemistry C},
  volume={123},
  number={13},
  pages={7786--7798},
  year={2018},
  publisher={ACS Publications},
  doi={10.1021/acs.jpcc.8b06438}
}
\">\n            <i class=\"fa fa-download fa-fw\"></i> Download BibTeX\n          </a>\n        </li>\n        <li>\n          <a href=\"//bibbase.org/rss?bib=https://jherasdo.github.io/publications.bib\">\n            <i class=\"fa fa-rss fa-fw\"></i> RSS Feed\n          </a>\n          </li>\n      </ul>\n      </li>\n\n      \n\n\n      \n    </ul>\n\n\n    <div class=\"alert alert-success bibbase_msg\" id=\"bibbase_msg_embed\"\n         style=\"display: none;\">\n\n      Excellent! Next you can\n      <a href=\"/network/register?next=/network/newSiteFromTemplate%3Fbiburl=https://jherasdo.github.io/publications.bib\"\n      >create a new website with this list</a>, or\n      embed it in an existing web page by copying &amp; pasting\n      any of the following snippets.\n\n      <div style=\"text-align: left; margin-top: 1em;\">\n        <strong>JavaScript</strong>\n        <span class=\"comment recommended\">(easiest)</span>\n        <div class=\"well well-small\">\n          <code>\n            &lt;script src=\"https://bibbase.org/show?bib=https%3A%2F%2Fjherasdo.github.io%2Fpublications.bib&amp;jsonp=1&amp;jsonp=1\"&gt;&lt;/script&gt;\n          </code>\n        </div>\n\n        <strong>PHP</strong>\n        <div class=\"well well-small\">\n          <code>\n            &lt;?php\n            $contents = file_get_contents(\"https://bibbase.org/show?bib=https%3A%2F%2Fjherasdo.github.io%2Fpublications.bib&amp;jsonp=1\");\n            print_r($contents);\n            ?&gt;\n          </code>\n        </div>\n\n        <strong>iFrame</strong>\n        <span class=\"comment\">(not recommended)</span>\n        <div class=\"well well-small\">\n          <code>\n            &lt;iframe src=\"https://bibbase.org/show?bib=https%3A%2F%2Fjherasdo.github.io%2Fpublications.bib&amp;jsonp=1\"&gt;&lt;/iframe&gt;\n          </code>\n        </div>\n\n        <p>\n          For more details see the <a href=\"//bibbase.org/help\">documention</a>.\n        </p>\n      </div>\n    </div>\n\n    <div class=\"alert alert-success bibbase_msg\" id=\"bibbase_msg_preview\"\n         style=\"display: none;\">\n\n      This is a preview! To use this list on your own web site\n      or create a new web site from it,\n      <a href=\"/network/register?next=/network/newAccountWithFile%3FfileId=\"\n      >create a free account</a>. The file will be added\n      and you will be able to edit it in the File Manager.\n      We will show you instructions once you've created your account.\n    </div>\n\n    <div class=\"alert alert-warning bibbase_msg\" id=\"bibbase_msg_mendeley1\"\n         style=\"display: none;\">\n\n      <p>To the site owner:</p>\n\n      <p><strong>Action required!</strong> Mendeley is changing its\n        API. In order to keep using Mendeley with BibBase past April\n        14th, you need to:\n        <ol>\n          <li>renew the authorization for BibBase on Mendeley, and</li>\n          <li>update the BibBase URL\n            in your page the same way you did when you initially set up\n            this page.\n          </li>\n        </ol>\n      </p>\n\n      <p>\n        <a href=\"http://bibbase.org/cgi-bin/mendeley2/get.py\">\n          <i class=\"fa fa-angle-double-right\"></i>\n          Fix it now</a>\n      </p>\n    </div>\n\n  </div>\n\n\n  <div id=\"bibbase_body\">\n    \n  \n  <div class=\"bibbase_group_whole\" id=\"group_2024\">\n    <div class=\"bibbase_group\"\n      onclick=\"toggleGroup('group_2024')\"\n      onkeypress=\"toggleGroup('group_2024')\"\n      tabindex=\"0\">\n      <i class=\"fa fa-angle-down bibbase_group_head_icon\"></i>&nbsp;\n      <span>2024</span>\n      <span class=\"bibbase_group_count\">\n        \n        (3)\n        \n      </span>\n    </div>\n    <div class=\"bibbase_group_body\">\n      \n  \n  <div class=\"bibbase_paper\" id=\"herasdomingo-garayruiz-pythonicchemistrythebeginnersguidetodigitalchemistry-2024\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1021/acs.jchemed.4c00840\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'herasdomingo-garayruiz-pythonicchemistrythebeginnersguidetodigitalchemistry-2024', 'https://doi.org/10.1021/acs.jchemed.4c00840', event);\">\n    Pythonic Chemistry: The Beginner’s Guide to Digital Chemistry.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>;  and Garay-Ruiz, D.\n</span>\n\n  \n\n</span>\n\n  <i>Journal of Chemical Education</i>.  2024.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1021/acs.jchemed.4c00840\"\n     onclick=\"log_download('herasdomingo-garayruiz-pythonicchemistrythebeginnersguidetodigitalchemistry-2024', 'https://doi.org/10.1021/acs.jchemed.4c00840', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"Pythonic Chemistry: The Beginner’s Guide to Digital Chemistry [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/herasdomingo-garayruiz-pythonicchemistrythebeginnersguidetodigitalchemistry-2024\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n  &nbsp;\n  <span class=\"bibbase_stats_paper\" style=\"color: #777;\">\n    <span>1 download</span>\n  </span>\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('herasdomingo-garayruiz-pythonicchemistrythebeginnersguidetodigitalchemistry-2024')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{heras2024pythonic,\n  title={Pythonic Chemistry: The Beginner’s Guide to Digital Chemistry},\n  author={Heras-Domingo, Javier and Garay-Ruiz, Diego},\n  journal={Journal of Chemical Education},\n  year={2024},\n  publisher={ACS Publications},\n  url={https://doi.org/10.1021/acs.jchemed.4c00840},\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"abed-herasdomingo-sanspeur-luo-alnoush-meira-wang-wang-etal-pourbaixmachinelearningframeworkidentifiesacidicwateroxidationcatalystsexhibitingsuppressedrutheniumdissolution-2024\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1021/jacs.4c01353\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'abed-herasdomingo-sanspeur-luo-alnoush-meira-wang-wang-etal-pourbaixmachinelearningframeworkidentifiesacidicwateroxidationcatalystsexhibitingsuppressedrutheniumdissolution-2024', 'https://doi.org/10.1021/jacs.4c01353', event);\">\n    Pourbaix Machine Learning Framework Identifies Acidic Water Oxidation Catalysts Exhibiting Suppressed Ruthenium Dissolution.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Abed, J.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Sanspeur, R. Y.; Luo, M.; Alnoush, W.; Meira, D. M.; Wang, H.; Wang, J.; Zhou, J.; Zhou, D.;  and others\n</span>\n\n  \n\n</span>\n\n  <i>Journal of the American Chemical Society</i>.  2024.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1021/jacs.4c01353\"\n     onclick=\"log_download('abed-herasdomingo-sanspeur-luo-alnoush-meira-wang-wang-etal-pourbaixmachinelearningframeworkidentifiesacidicwateroxidationcatalystsexhibitingsuppressedrutheniumdissolution-2024', 'https://doi.org/10.1021/jacs.4c01353', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"Pourbaix Machine Learning Framework Identifies Acidic Water Oxidation Catalysts Exhibiting Suppressed Ruthenium Dissolution [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/abed-herasdomingo-sanspeur-luo-alnoush-meira-wang-wang-etal-pourbaixmachinelearningframeworkidentifiesacidicwateroxidationcatalystsexhibitingsuppressedrutheniumdissolution-2024\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('abed-herasdomingo-sanspeur-luo-alnoush-meira-wang-wang-etal-pourbaixmachinelearningframeworkidentifiesacidicwateroxidationcatalystsexhibitingsuppressedrutheniumdissolution-2024')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{abed2024pourbaix,\n  title={Pourbaix Machine Learning Framework Identifies Acidic Water Oxidation Catalysts Exhibiting Suppressed Ruthenium Dissolution},\n  author={Abed, Jehad and Heras-Domingo, Javier and Sanspeur, Rohan Yuri and Luo, Mingchuan and Alnoush, Wajdi and Meira, Debora Motta and Wang, Hsiaotsu and Wang, Jian and Zhou, Jigang and Zhou, Daojin and others},\n  journal={Journal of the American Chemical Society},\n  year={2024},\n  publisher={ACS Publications},\n  url={https://doi.org/10.1021/jacs.4c01353},\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"rossi-ruizferrando-akl-abalos-herasdomingo-graux-hai-lu-etal-quantitativedescriptionofmetalcenterorganizationandinteractionsinsingleatomcatalysts-2024\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1002/adma.202307991\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'rossi-ruizferrando-akl-abalos-herasdomingo-graux-hai-lu-etal-quantitativedescriptionofmetalcenterorganizationandinteractionsinsingleatomcatalysts-2024', 'https://doi.org/10.1002/adma.202307991', event);\">\n    Quantitative Description of Metal Center Organization and Interactions in Single-Atom Catalysts.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Rossi, K.; Ruiz-Ferrando, A.; Akl, D. F.; Abalos, V. G.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Graux, R.; Hai, X.; Lu, J.; Garcia-Gasulla, D.; López, N.;  and others\n</span>\n\n  \n\n</span>\n\n  <i>Advanced Materials</i>,2307991.  2024.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1002/adma.202307991\"\n     onclick=\"log_download('rossi-ruizferrando-akl-abalos-herasdomingo-graux-hai-lu-etal-quantitativedescriptionofmetalcenterorganizationandinteractionsinsingleatomcatalysts-2024', 'https://doi.org/10.1002/adma.202307991', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"Quantitative Description of Metal Center Organization and Interactions in Single-Atom Catalysts [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/rossi-ruizferrando-akl-abalos-herasdomingo-graux-hai-lu-etal-quantitativedescriptionofmetalcenterorganizationandinteractionsinsingleatomcatalysts-2024\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('rossi-ruizferrando-akl-abalos-herasdomingo-graux-hai-lu-etal-quantitativedescriptionofmetalcenterorganizationandinteractionsinsingleatomcatalysts-2024')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{rossi2023quantitative,\n  title={Quantitative Description of Metal Center Organization and Interactions in Single-Atom Catalysts},\n  author={Rossi, Kevin and Ruiz-Ferrando, Andrea and Akl, Dario Faust and Abalos, Victor Gimenez and Heras-Domingo, Javier and Graux, Romain and Hai, Xiao and Lu, Jiong and Garcia-Gasulla, Dario and L{\\&#x27;o}pez, Nuria and others},\n  journal={Advanced Materials},\n  pages={2307991},\n  year={2024},\n  publisher={Wiley Online Library},\n  url={https://doi.org/10.1002/adma.202307991}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n\n\n\n    </div>\n  </div>\n\n  <div class=\"bibbase_group_whole\" id=\"group_2023\">\n    <div class=\"bibbase_group\"\n      onclick=\"toggleGroup('group_2023')\"\n      onkeypress=\"toggleGroup('group_2023')\"\n      tabindex=\"0\">\n      <i class=\"fa fa-angle-down bibbase_group_head_icon\"></i>&nbsp;\n      <span>2023</span>\n      <span class=\"bibbase_group_count\">\n        \n        (5)\n        \n      </span>\n    </div>\n    <div class=\"bibbase_group_body\">\n      \n  \n  <div class=\"bibbase_paper\" id=\"garrison-herasdomingo-kitchin-dospassosgomes-ulissi-blau-applyinglargegraphneuralnetworkstopredicttransitionmetalcomplexenergiesusingthetmqmwb97mvdataset-2023\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1021/acs.jcim.3c01226\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'garrison-herasdomingo-kitchin-dospassosgomes-ulissi-blau-applyinglargegraphneuralnetworkstopredicttransitionmetalcomplexenergiesusingthetmqmwb97mvdataset-2023', 'https://doi.org/10.1021/acs.jcim.3c01226', event);\">\n    Applying Large Graph Neural Networks to Predict Transition Metal Complex Energies Using the tmQM_wB97MV Data Set.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Garrison, A. G; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Kitchin, J. R; dos Passos Gomes, G.; Ulissi, Z. W;  and Blau, S. M\n</span>\n\n  \n\n</span>\n\n  <i>Journal of Chemical Information and Modeling</i>.  2023.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1021/acs.jcim.3c01226\"\n     onclick=\"log_download('garrison-herasdomingo-kitchin-dospassosgomes-ulissi-blau-applyinglargegraphneuralnetworkstopredicttransitionmetalcomplexenergiesusingthetmqmwb97mvdataset-2023', 'https://doi.org/10.1021/acs.jcim.3c01226', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"Applying Large Graph Neural Networks to Predict Transition Metal Complex Energies Using the tmQM_wB97MV Data Set [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/garrison-herasdomingo-kitchin-dospassosgomes-ulissi-blau-applyinglargegraphneuralnetworkstopredicttransitionmetalcomplexenergiesusingthetmqmwb97mvdataset-2023\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('garrison-herasdomingo-kitchin-dospassosgomes-ulissi-blau-applyinglargegraphneuralnetworkstopredicttransitionmetalcomplexenergiesusingthetmqmwb97mvdataset-2023')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{garrison2023applying,\n  title={Applying Large Graph Neural Networks to Predict Transition Metal Complex Energies Using the tmQM\\_wB97MV Data Set},\n  author={Garrison, Aaron G and Heras-Domingo, Javier and Kitchin, John R and dos Passos Gomes, Gabriel and Ulissi, Zachary W and Blau, Samuel M},\n  journal={Journal of Chemical Information and Modeling},\n  year={2023},\n  publisher={ACS Publications},\n  url={https://doi.org/10.1021/acs.jcim.3c01226},\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"romero-fenoll-gil-campos-creus-mart-herasdomingo-collire-etal-rubasednanoparticlessupportedincarbonnanotubesforelectrocatalytichydrogenevolutionstructuralandelectroniceffects-2023\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1039/D3QI00698K\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'romero-fenoll-gil-campos-creus-mart-herasdomingo-collire-etal-rubasednanoparticlessupportedincarbonnanotubesforelectrocatalytichydrogenevolutionstructuralandelectroniceffects-2023', 'https://doi.org/10.1039/D3QI00698K', event);\">\n    Ru-based nanoparticles supported in carbon nanotubes for electrocatalytic hydrogen evolution: structural and electronic effects.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Romero, N.; Fenoll, D.; Gil, L.; Campos, S.; Creus, J.; Martı́, Gerard; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Collière, V.; Mesa, C. A; Gimenez, S.;  and others\n</span>\n\n  \n\n</span>\n\n  <i>Inorganic Chemistry Frontiers</i>.  2023.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1039/D3QI00698K\"\n     onclick=\"log_download('romero-fenoll-gil-campos-creus-mart-herasdomingo-collire-etal-rubasednanoparticlessupportedincarbonnanotubesforelectrocatalytichydrogenevolutionstructuralandelectroniceffects-2023', 'https://doi.org/10.1039/D3QI00698K', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"Ru-based nanoparticles supported in carbon nanotubes for electrocatalytic hydrogen evolution: structural and electronic effects [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/romero-fenoll-gil-campos-creus-mart-herasdomingo-collire-etal-rubasednanoparticlessupportedincarbonnanotubesforelectrocatalytichydrogenevolutionstructuralandelectroniceffects-2023\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('romero-fenoll-gil-campos-creus-mart-herasdomingo-collire-etal-rubasednanoparticlessupportedincarbonnanotubesforelectrocatalytichydrogenevolutionstructuralandelectroniceffects-2023')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{romero2023ru,\n  title={Ru-based nanoparticles supported in carbon nanotubes for electrocatalytic hydrogen evolution: structural and electronic effects},\n  author={Romero, Nuria and Fenoll, Didac and Gil, Laia and Campos, Sergi and Creus, Jordi and Mart{\\&#x27;\\i}, Gerard and Heras-Domingo, Javier and Colli{\\&#x60;e}re, Vincent and Mesa, Camilo A and Gimenez, Sixto and others},\n  journal={Inorganic Chemistry Frontiers},\n  year={2023},\n  publisher={Royal Society of Chemistry},\n  url={https://doi.org/10.1039/D3QI00698K}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"sanspeur-herasdomingo-kitchin-ulissi-wherewulffasemiautonomousworkflowforsystematiccatalystsurfacereactivityunderreactionconditions-2023\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1021/acs.jcim.3c00142\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'sanspeur-herasdomingo-kitchin-ulissi-wherewulffasemiautonomousworkflowforsystematiccatalystsurfacereactivityunderreactionconditions-2023', 'https://doi.org/10.1021/acs.jcim.3c00142', event);\">\n    WhereWulff: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Sanspeur, R. Y.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Kitchin, J. R;  and Ulissi, Z.\n</span>\n\n  \n\n</span>\n\n  <i>Journal of Chemical Information and Modeling</i>.  2023.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1021/acs.jcim.3c00142\"\n     onclick=\"log_download('sanspeur-herasdomingo-kitchin-ulissi-wherewulffasemiautonomousworkflowforsystematiccatalystsurfacereactivityunderreactionconditions-2023', 'https://doi.org/10.1021/acs.jcim.3c00142', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"WhereWulff: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/sanspeur-herasdomingo-kitchin-ulissi-wherewulffasemiautonomousworkflowforsystematiccatalystsurfacereactivityunderreactionconditions-2023\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('sanspeur-herasdomingo-kitchin-ulissi-wherewulffasemiautonomousworkflowforsystematiccatalystsurfacereactivityunderreactionconditions-2023')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{sanspeur2023wherewulff,\n  title={WhereWulff: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions},\n  author={Sanspeur, Rohan Yuri and Heras-Domingo, Javier and Kitchin, John R and Ulissi, Zachary},\n  journal={Journal of Chemical Information and Modeling},\n  year={2023},\n  publisher={ACS Publications},\n  url={https://doi.org/10.1021/acs.jcim.3c00142}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"tran-lan-shuaibi-wood-goyal-das-herasdomingo-kolluru-etal-theopencatalyst2022oc22datasetandchallengesforoxideelectrocatalysts-2023\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1021/acscatal.2c05426\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'tran-lan-shuaibi-wood-goyal-das-herasdomingo-kolluru-etal-theopencatalyst2022oc22datasetandchallengesforoxideelectrocatalysts-2023', 'https://doi.org/10.1021/acscatal.2c05426', event);\">\n    The Open Catalyst 2022 (OC22) dataset and challenges for oxide electrocatalysts.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Tran, R.; Lan, J.; Shuaibi, M.; Wood, B. M; Goyal, S.; Das, A.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Kolluru, A.; Rizvi, A.; Shoghi, N.;  and others\n</span>\n\n  \n\n</span>\n\n  <i>ACS Catalysis</i>, 13(5): 3066–3084.  2023.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1021/acscatal.2c05426\"\n     onclick=\"log_download('tran-lan-shuaibi-wood-goyal-das-herasdomingo-kolluru-etal-theopencatalyst2022oc22datasetandchallengesforoxideelectrocatalysts-2023', 'https://doi.org/10.1021/acscatal.2c05426', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"The Open Catalyst 2022 (OC22) dataset and challenges for oxide electrocatalysts [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/tran-lan-shuaibi-wood-goyal-das-herasdomingo-kolluru-etal-theopencatalyst2022oc22datasetandchallengesforoxideelectrocatalysts-2023\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('tran-lan-shuaibi-wood-goyal-das-herasdomingo-kolluru-etal-theopencatalyst2022oc22datasetandchallengesforoxideelectrocatalysts-2023')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{tran2023open,\n  title={The Open Catalyst 2022 (OC22) dataset and challenges for oxide electrocatalysts},\n  author={Tran, Richard and Lan, Janice and Shuaibi, Muhammed and Wood, Brandon M and Goyal, Siddharth and Das, Abhishek and Heras-Domingo, Javier and Kolluru, Adeesh and Rizvi, Ammar and Shoghi, Nima and others},\n  journal={ACS Catalysis},\n  volume={13},\n  number={5},\n  pages={3066--3084},\n  year={2023},\n  publisher={ACS Publications},\n  url={https://doi.org/10.1021/acscatal.2c05426}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"abed-herasdomingo-luo-sanspeur-alnoush-meira-wang-wang-etal-multidescriptordesignofrutheniumcatalystsfordurableacidicwateroxidation-2023\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.21203/rs.3.rs-2410178/v1\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'abed-herasdomingo-luo-sanspeur-alnoush-meira-wang-wang-etal-multidescriptordesignofrutheniumcatalystsfordurableacidicwateroxidation-2023', 'https://doi.org/10.21203/rs.3.rs-2410178/v1', event);\">\n    Multi-Descriptor Design of Ruthenium Catalysts for Durable Acidic Water Oxidation.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Abed, J.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Luo, M.; Sanspeur, R.; Alnoush, W.; Meira, D.; Wang, H.; Wang, J.; Zhou, J.; Zhou, D.;  and others\n</span>\n\n  \n\n</span>\n\n  <i>Preprint</i>.  2023.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.21203/rs.3.rs-2410178/v1\"\n     onclick=\"log_download('abed-herasdomingo-luo-sanspeur-alnoush-meira-wang-wang-etal-multidescriptordesignofrutheniumcatalystsfordurableacidicwateroxidation-2023', 'https://doi.org/10.21203/rs.3.rs-2410178/v1', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"Multi-Descriptor Design of Ruthenium Catalysts for Durable Acidic Water Oxidation [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/abed-herasdomingo-luo-sanspeur-alnoush-meira-wang-wang-etal-multidescriptordesignofrutheniumcatalystsfordurableacidicwateroxidation-2023\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n  &nbsp;\n  <span class=\"bibbase_stats_paper\" style=\"color: #777;\">\n    <span>1 download</span>\n  </span>\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('abed-herasdomingo-luo-sanspeur-alnoush-meira-wang-wang-etal-multidescriptordesignofrutheniumcatalystsfordurableacidicwateroxidation-2023')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{abed2023multi,\n  title={Multi-Descriptor Design of Ruthenium Catalysts for Durable Acidic Water Oxidation},\n  author={Abed, Jehad and Heras-Domingo, Javier and Luo, Mingchuan and Sanspeur, Rohan and Alnoush, Wajdi and Meira, Debora and Wang, Hsiao-Tsu and Wang, Jian and Zhou, Jigang and Zhou, Daojin and others},\n  journal={Preprint},\n  year={2023},\n  url={https://doi.org/10.21203/rs.3.rs-2410178/v1}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n\n\n\n    </div>\n  </div>\n\n  <div class=\"bibbase_group_whole\" id=\"group_2021\">\n    <div class=\"bibbase_group\"\n      onclick=\"toggleGroup('group_2021')\"\n      onkeypress=\"toggleGroup('group_2021')\"\n      tabindex=\"0\">\n      <i class=\"fa fa-angle-down bibbase_group_head_icon\"></i>&nbsp;\n      <span>2021</span>\n      <span class=\"bibbase_group_count\">\n        \n        (2)\n        \n      </span>\n    </div>\n    <div class=\"bibbase_group_body\">\n      \n  \n  <div class=\"bibbase_paper\" id=\"gonzlez-herasdomingo-sodupe-rodrguezsantiago-solansmonfort-importanceoftheoxylcharacterontheiro2surfacedependentcatalyticactivityfortheoxygenevolutionreaction-2021\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1016/j.jcat.2021.02.026\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'gonzlez-herasdomingo-sodupe-rodrguezsantiago-solansmonfort-importanceoftheoxylcharacterontheiro2surfacedependentcatalyticactivityfortheoxygenevolutionreaction-2021', 'https://doi.org/10.1016/j.jcat.2021.02.026', event);\">\n    Importance of the oxyl character on the IrO2 surface dependent catalytic activity for the oxygen evolution reaction.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  González, D.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Sodupe, M.; Rodrı́guez-Santiago, Luis;  and Solans-Monfort, X.\n</span>\n\n  \n\n</span>\n\n  <i>Journal of Catalysis</i>, 396: 192–201.  2021.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1016/j.jcat.2021.02.026\"\n     onclick=\"log_download('gonzlez-herasdomingo-sodupe-rodrguezsantiago-solansmonfort-importanceoftheoxylcharacterontheiro2surfacedependentcatalyticactivityfortheoxygenevolutionreaction-2021', 'https://doi.org/10.1016/j.jcat.2021.02.026', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"Importance of the oxyl character on the IrO2 surface dependent catalytic activity for the oxygen evolution reaction [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/gonzlez-herasdomingo-sodupe-rodrguezsantiago-solansmonfort-importanceoftheoxylcharacterontheiro2surfacedependentcatalyticactivityfortheoxygenevolutionreaction-2021\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('gonzlez-herasdomingo-sodupe-rodrguezsantiago-solansmonfort-importanceoftheoxylcharacterontheiro2surfacedependentcatalyticactivityfortheoxygenevolutionreaction-2021')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{gonzalez2021importance,\n  title={Importance of the oxyl character on the IrO2 surface dependent catalytic activity for the oxygen evolution reaction},\n  author={Gonz{\\&#x27;a}lez, Danilo and Heras-Domingo, Javier and Sodupe, Mariona and Rodr{\\&#x27;\\i}guez-Santiago, Luis and Solans-Monfort, Xavier},\n  journal={Journal of Catalysis},\n  volume={396},\n  pages={192--201},\n  year={2021},\n  publisher={Elsevier},\n  url={https://doi.org/10.1016/j.jcat.2021.02.026}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"chanussot-das-goyal-lavril-shuaibi-riviere-tran-herasdomingo-etal-opencatalyst2020oc20datasetandcommunitychallenges-2021\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://doi.org/10.1021/acscatal.0c04525\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'chanussot-das-goyal-lavril-shuaibi-riviere-tran-herasdomingo-etal-opencatalyst2020oc20datasetandcommunitychallenges-2021', 'https://doi.org/10.1021/acscatal.0c04525', event);\">\n    Open catalyst 2020 (OC20) dataset and community challenges.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Chanussot, L.; Das, A.; Goyal, S.; Lavril, T.; Shuaibi, M.; Riviere, M.; Tran, K.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Ho, C.; Hu, W.;  and others\n</span>\n\n  \n\n</span>\n\n  <i>Acs Catalysis</i>, 11(10): 6059–6072.  2021.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://doi.org/10.1021/acscatal.0c04525\"\n     onclick=\"log_download('chanussot-das-goyal-lavril-shuaibi-riviere-tran-herasdomingo-etal-opencatalyst2020oc20datasetandcommunitychallenges-2021', 'https://doi.org/10.1021/acscatal.0c04525', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"Open catalyst 2020 (OC20) dataset and community challenges [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/chanussot-das-goyal-lavril-shuaibi-riviere-tran-herasdomingo-etal-opencatalyst2020oc20datasetandcommunitychallenges-2021\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n  &nbsp;\n  <span class=\"bibbase_stats_paper\" style=\"color: #777;\">\n    <span>7 downloads</span>\n  </span>\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('chanussot-das-goyal-lavril-shuaibi-riviere-tran-herasdomingo-etal-opencatalyst2020oc20datasetandcommunitychallenges-2021')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{chanussot2021open,\n  title={Open catalyst 2020 (OC20) dataset and community challenges},\n  author={Chanussot, Lowik and Das, Abhishek and Goyal, Siddharth and Lavril, Thibaut and Shuaibi, Muhammed and Riviere, Morgane and Tran, Kevin and Heras-Domingo, Javier and Ho, Caleb and Hu, Weihua and others},\n  journal={Acs Catalysis},\n  volume={11},\n  number={10},\n  pages={6059--6072},\n  year={2021},\n  publisher={ACS Publications},\n  url={https://doi.org/10.1021/acscatal.0c04525}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n\n\n\n    </div>\n  </div>\n\n  <div class=\"bibbase_group_whole\" id=\"group_2020\">\n    <div class=\"bibbase_group\"\n      onclick=\"toggleGroup('group_2020')\"\n      onkeypress=\"toggleGroup('group_2020')\"\n      tabindex=\"0\">\n      <i class=\"fa fa-angle-down bibbase_group_head_icon\"></i>&nbsp;\n      <span>2020</span>\n      <span class=\"bibbase_group_count\">\n        \n        (3)\n        \n      </span>\n    </div>\n    <div class=\"bibbase_group_body\">\n      \n  \n  <div class=\"bibbase_paper\" id=\"zitnick-chanussot-das-goyal-herasdomingo-ho-hu-lavril-etal-anintroductiontoelectrocatalystdesignusingmachinelearningforrenewableenergystorage-2020\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  <a href=\"https://arxiv.org/abs/2010.09435\"\n     onclick=\"return trackOutboundLink('publications', 'click', 'zitnick-chanussot-das-goyal-herasdomingo-ho-hu-lavril-etal-anintroductiontoelectrocatalystdesignusingmachinelearningforrenewableenergystorage-2020', 'https://arxiv.org/abs/2010.09435', event);\">\n    An Introduction to Electrocatalyst Design using Machine Learning for Renewable Energy Storage.\n  </a>\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Zitnick, C. L.; Chanussot, L.; Das, A.; Goyal, S.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Ho, C.; Hu, W.; Lavril, T.; Palizhati, A.; Rivière, M.; Shuaibi, M.; Sriram, A.; Tran, K.; Wood, B.; Yoon, J.; Parikh, D.;  and <a class=\"bibbase author link\" href=\"https://ulissigroup.cheme.cmu.edu/publications/\">Ulissi, Z.</a>\n</span>\n\n  \n\n</span>\n\n  <i>ArXiv</i>, abs/2010.09435.  2020.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n  <a href=\"https://arxiv.org/abs/2010.09435\"\n     onclick=\"log_download('zitnick-chanussot-das-goyal-herasdomingo-ho-hu-lavril-etal-anintroductiontoelectrocatalystdesignusingmachinelearningforrenewableenergystorage-2020', 'https://arxiv.org/abs/2010.09435', event.ctrlKey, event)\">\n    <img src=\"//bibbase.org/img/filetypes/link.svg\"\n\t     alt=\"An Introduction to Electrocatalyst Design using Machine Learning for Renewable Energy Storage [link]\"\n       title=\"Paper\"\n\t     class=\"bibbase_icon\"\n         ><span class=\"bibbase_icon_text\">Paper</span></a>\n  &nbsp;\n  \n\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/zitnick-chanussot-das-goyal-herasdomingo-ho-hu-lavril-etal-anintroductiontoelectrocatalystdesignusingmachinelearningforrenewableenergystorage-2020\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n  &nbsp;\n  <span class=\"bibbase_stats_paper\" style=\"color: #777;\">\n    <span>1 download</span>\n  </span>\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('zitnick-chanussot-das-goyal-herasdomingo-ho-hu-lavril-etal-anintroductiontoelectrocatalystdesignusingmachinelearningforrenewableenergystorage-2020')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{Zitnick2020AnIT,\n  title={An Introduction to Electrocatalyst Design using Machine Learning for Renewable Energy Storage},\n  author={C. L. Zitnick and L. Chanussot and Abhishek Das and Siddharth Goyal and J. Heras-Domingo and Caleb Ho and Weihua Hu and Thibaut Lavril and Aini Palizhati and M. Rivi{\\&#x60;e}re and Muhammed Shuaibi and Anuroop Sriram and K. Tran and B. Wood and J. Yoon and D. Parikh and Zachary Ulissi},\n  journal={ArXiv},\n  year={2020},\n  volume={abs/2010.09435},\n  url={https://arxiv.org/abs/2010.09435}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"lebedev-ezhov-herasdomingo-comasvives-kaeffer-willinger-solansmonfort-huang-etal-atomicallydispersediridiumonindiumtinoxideefficientlycatalyzeswateroxidation-2020\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  Atomically Dispersed Iridium on Indium Tin Oxide Efficiently Catalyzes Water Oxidation.\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Lebedev, D.; Ezhov, R.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Comas-Vives, A.; Kaeffer, N.; Willinger, M.; Solans-Monfort, X.; Huang, X.; Pushkar, Y.;  and Copéret, C.\n</span>\n\n  \n\n</span>\n\n  <i>ACS central science</i>, 6(7): 1189–1198.  2020.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n\n  \n  <a href=\"http://doi.org/10.1021/acscentsci.0c00604\"\n     onclick=\"log_download('lebedev-ezhov-herasdomingo-comasvives-kaeffer-willinger-solansmonfort-huang-etal-atomicallydispersediridiumonindiumtinoxideefficientlycatalyzeswateroxidation-2020', 'http://doi.org/10.1021/acscentsci.0c00604', event.ctrlKey)\"\n     class=\"bibbase doi link\">\n    <span>doi</span></a>\n  &nbsp;\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/lebedev-ezhov-herasdomingo-comasvives-kaeffer-willinger-solansmonfort-huang-etal-atomicallydispersediridiumonindiumtinoxideefficientlycatalyzeswateroxidation-2020\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('lebedev-ezhov-herasdomingo-comasvives-kaeffer-willinger-solansmonfort-huang-etal-atomicallydispersediridiumonindiumtinoxideefficientlycatalyzeswateroxidation-2020')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{lebedev2020atomically,\n  title={Atomically Dispersed Iridium on Indium Tin Oxide Efficiently Catalyzes Water Oxidation},\n  author={Lebedev, Dmitry and Ezhov, Roman and Heras-Domingo, Javier and Comas-Vives, Aleix and Kaeffer, Nicolas and Willinger, Marc and Solans-Monfort, Xavier and Huang, Xing and Pushkar, Yulia and Cop{\\&#x27;e}ret, Christophe},\n  journal={ACS central science},\n  volume={6},\n  number={7},\n  pages={1189--1198},\n  year={2020},\n  publisher={ACS Publications},\n  doi={10.1021/acscentsci.0c00604}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"gonzlez-camino-herasdomingo-rimola-rodrguezsantiago-solansmonfort-sodupe-bcnmafreecomputationaltoolforgeneratingwulfflikenanoparticlemodelswithcontrolledstoichiometry-2020\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  BCN-M: A Free Computational Tool for Generating Wulff-like Nanoparticle Models with Controlled Stoichiometry.\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  González, D.; Camino, B.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Rimola, A.; Rodríguez-Santiago, L.; Solans-Monfort, X.;  and Sodupe, M.\n</span>\n\n  \n\n</span>\n\n  <i>The Journal of Physical Chemistry C</i>, 124(1): 1227-1237.  2020.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n\n  \n  <a href=\"http://doi.org/10.1021/acs.jpcc.9b10506\"\n     onclick=\"log_download('gonzlez-camino-herasdomingo-rimola-rodrguezsantiago-solansmonfort-sodupe-bcnmafreecomputationaltoolforgeneratingwulfflikenanoparticlemodelswithcontrolledstoichiometry-2020', 'http://doi.org/10.1021/acs.jpcc.9b10506', event.ctrlKey)\"\n     class=\"bibbase doi link\">\n    <span>doi</span></a>\n  &nbsp;\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/gonzlez-camino-herasdomingo-rimola-rodrguezsantiago-solansmonfort-sodupe-bcnmafreecomputationaltoolforgeneratingwulfflikenanoparticlemodelswithcontrolledstoichiometry-2020\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('gonzlez-camino-herasdomingo-rimola-rodrguezsantiago-solansmonfort-sodupe-bcnmafreecomputationaltoolforgeneratingwulfflikenanoparticlemodelswithcontrolledstoichiometry-2020')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{doi:10.1021/acs.jpcc.9b10506,\nauthor = {González, Danilo and Camino, Bruno and Heras-Domingo, Javier and Rimola, Albert and Rodríguez-Santiago, Luis and Solans-Monfort, Xavier and Sodupe, Mariona},\ntitle = {BCN-M: A Free Computational Tool for Generating Wulff-like Nanoparticle Models with Controlled Stoichiometry},\njournal = {The Journal of Physical Chemistry C},\nvolume = {124},\nnumber = {1},\npages = {1227-1237},\nyear = {2020},\ndoi = {10.1021/acs.jpcc.9b10506}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n\n\n\n    </div>\n  </div>\n\n  <div class=\"bibbase_group_whole\" id=\"group_2019\">\n    <div class=\"bibbase_group\"\n      onclick=\"toggleGroup('group_2019')\"\n      onkeypress=\"toggleGroup('group_2019')\"\n      tabindex=\"0\">\n      <i class=\"fa fa-angle-down bibbase_group_head_icon\"></i>&nbsp;\n      <span>2019</span>\n      <span class=\"bibbase_group_count\">\n        \n        (2)\n        \n      </span>\n    </div>\n    <div class=\"bibbase_group_body\">\n      \n  \n  <div class=\"bibbase_paper\" id=\"luisbarrerra-cano-imanishakibaei-herasdomingo-prezcarvajal-imaz-maspoch-solansmonfort-etal-switchingacidicandbasiccatalysisthroughsupramolecularfunctionalizationinaporous3dcovalentiminebasedmaterial-2019\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  Switching acidic and basic catalysis through supramolecular functionalization in a porous 3D covalent imine-based material.\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Luis-Barrerra, J.; Cano, R.; Imani-Shakibaei, G.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Pérez-Carvajal, J.; Imaz, I.; Maspoch, D.; Solans-Monfort, X.; Alemán, J.;  and Mas-Ballesté, R.\n</span>\n\n  \n\n</span>\n\n  <i>Catalysis Science & Technology</i>, 9(21): 6007–6014.  2019.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n\n  \n  <a href=\"http://doi.org/10.1039/C9CY01527B\"\n     onclick=\"log_download('luisbarrerra-cano-imanishakibaei-herasdomingo-prezcarvajal-imaz-maspoch-solansmonfort-etal-switchingacidicandbasiccatalysisthroughsupramolecularfunctionalizationinaporous3dcovalentiminebasedmaterial-2019', 'http://doi.org/10.1039/C9CY01527B', event.ctrlKey)\"\n     class=\"bibbase doi link\">\n    <span>doi</span></a>\n  &nbsp;\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/luisbarrerra-cano-imanishakibaei-herasdomingo-prezcarvajal-imaz-maspoch-solansmonfort-etal-switchingacidicandbasiccatalysisthroughsupramolecularfunctionalizationinaporous3dcovalentiminebasedmaterial-2019\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('luisbarrerra-cano-imanishakibaei-herasdomingo-prezcarvajal-imaz-maspoch-solansmonfort-etal-switchingacidicandbasiccatalysisthroughsupramolecularfunctionalizationinaporous3dcovalentiminebasedmaterial-2019')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{luis2019switching,\n  title={Switching acidic and basic catalysis through supramolecular functionalization in a porous 3D covalent imine-based material},\n  author={Luis-Barrerra, Javier and Cano, Rafael and Imani-Shakibaei, Ghazaleh and Heras-Domingo, Javier and P{\\&#x27;e}rez-Carvajal, Javier and Imaz, Inhar and Maspoch, Daniel and Solans-Monfort, Xavier and Alem{\\&#x27;a}n, Jos{\\&#x27;e} and Mas-Ballest{\\&#x27;e}, Rub{\\&#x27;e}n},\n  journal={Catalysis Science \\&amp; Technology},\n  volume={9},\n  number={21},\n  pages={6007--6014},\n  year={2019},\n  publisher={Royal Society of Chemistry},\n  doi={10.1039/C9CY01527B}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n  <div class=\"bibbase_paper\" id=\"gonzalez-herasdomingo-pantaleone-rimola-rodriguezsantiago-solansmonfort-sodupe-wateradsorptiononmo2mtiruandirsurfacesimportanceofoctahedraldistortionandcooperativeeffects-2019\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  Water Adsorption on MO2 (M= Ti, Ru, and Ir) Surfaces. Importance of Octahedral Distortion and Cooperative Effects.\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  Gonzalez, D.; <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Pantaleone, S.; Rimola, A.; Rodriguez-Santiago, L.; Solans-Monfort, X.;  and Sodupe, M.\n</span>\n\n  \n\n</span>\n\n  <i>ACS omega</i>, 4(2): 2989–2999.  2019.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n\n  \n  <a href=\"http://doi.org/10.1021/acsomega.8b03350\"\n     onclick=\"log_download('gonzalez-herasdomingo-pantaleone-rimola-rodriguezsantiago-solansmonfort-sodupe-wateradsorptiononmo2mtiruandirsurfacesimportanceofoctahedraldistortionandcooperativeeffects-2019', 'http://doi.org/10.1021/acsomega.8b03350', event.ctrlKey)\"\n     class=\"bibbase doi link\">\n    <span>doi</span></a>\n  &nbsp;\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/gonzalez-herasdomingo-pantaleone-rimola-rodriguezsantiago-solansmonfort-sodupe-wateradsorptiononmo2mtiruandirsurfacesimportanceofoctahedraldistortionandcooperativeeffects-2019\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('gonzalez-herasdomingo-pantaleone-rimola-rodriguezsantiago-solansmonfort-sodupe-wateradsorptiononmo2mtiruandirsurfacesimportanceofoctahedraldistortionandcooperativeeffects-2019')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{gonzalez2019water,\n  title={Water Adsorption on MO2 (M= Ti, Ru, and Ir) Surfaces. Importance of Octahedral Distortion and Cooperative Effects},\n  author={Gonzalez, Danilo and Heras-Domingo, Javier and Pantaleone, Stefano and Rimola, Albert and Rodriguez-Santiago, Luis and Solans-Monfort, Xavier and Sodupe, Mariona},\n  journal={ACS omega},\n  volume={4},\n  number={2},\n  pages={2989--2999},\n  year={2019},\n  publisher={ACS Publications},\n  doi={10.1021/acsomega.8b03350}\n}\n\n</pre>\n</div>\n\n\n\n</div>\n\n\n\n\n\n    </div>\n  </div>\n\n  <div class=\"bibbase_group_whole\" id=\"group_2018\">\n    <div class=\"bibbase_group\"\n      onclick=\"toggleGroup('group_2018')\"\n      onkeypress=\"toggleGroup('group_2018')\"\n      tabindex=\"0\">\n      <i class=\"fa fa-angle-down bibbase_group_head_icon\"></i>&nbsp;\n      <span>2018</span>\n      <span class=\"bibbase_group_count\">\n        \n        (1)\n        \n      </span>\n    </div>\n    <div class=\"bibbase_group_body\">\n      \n  \n  <div class=\"bibbase_paper\" id=\"herasdomingo-sodupe-solansmonfort-interactionbetweenrutheniumoxidesurfacesandwatermoleculeseffectofsurfacemorphologyandwatercoverage-2018\">\n  <span class=\"bibbase_paper_titleauthoryear\">\n\n  \n  <span class=\"bibbase_paper_title\">\n  \n  \n  \n  Interaction between ruthenium oxide surfaces and water molecules. Effect of surface morphology and water coverage.\n  \n  \n  \n</span>\n\n  <span class=\"bibbase_paper_author\">\n  <a class=\"bibbase author link\" href=\"https://jherasdo.github.io/publications/\">Heras-Domingo, J.</a>; Sodupe, M.;  and Solans-Monfort, X.\n</span>\n\n  \n\n</span>\n\n  <i>The Journal of Physical Chemistry C</i>, 123(13): 7786–7798.  2018.\n  <span class=\"note\"></span>\n\n<span class=\"bibbase_note\"></span>\n\n<br class=\"bibbase_paper_content\"/>\n\n<span class=\"bibbase_paper_content dontprint\">\n\n  \n\n  \n  <a href=\"http://doi.org/10.1021/acs.jpcc.8b06438\"\n     onclick=\"log_download('herasdomingo-sodupe-solansmonfort-interactionbetweenrutheniumoxidesurfacesandwatermoleculeseffectofsurfacemorphologyandwatercoverage-2018', 'http://doi.org/10.1021/acs.jpcc.8b06438', event.ctrlKey)\"\n     class=\"bibbase doi link\">\n    <span>doi</span></a>\n  &nbsp;\n  \n\n  \n  <a href=\"//bibbase.org/network/publication/herasdomingo-sodupe-solansmonfort-interactionbetweenrutheniumoxidesurfacesandwatermoleculeseffectofsurfacemorphologyandwatercoverage-2018\"\n     class=\"bibbase bibbase_page link\">link</a>\n  &nbsp;\n  \n\n  <a href=\"#\"\n     onclick=\"showBib(event); return false;\"\n     class=\"bibbase bibtex link\">bibtex\n    <i class=\"fa fa-caret-down\"></i></a>\n\n  \n\n  \n\n  <!-- <a class=\"bibbase read link hidden\" -->\n  <!--    href=\"javascript:toggleRead('herasdomingo-sodupe-solansmonfort-interactionbetweenrutheniumoxidesurfacesandwatermoleculeseffectofsurfacemorphologyandwatercoverage-2018')\" -->\n  <!--    title=\"Marking this paper as read adds it to your library on BibBase.\" -->\n  <!--    > -->\n  <!--   <i class=\"fa fa-check\"></i>&nbsp; -->\n  <!--   <span>mark as read</span> -->\n  <!-- </a> -->\n\n  &nbsp;\n  \n  \n\n</span>\n\n<div class=\"well well-small bibbase\" data-type=\"bibtex\"\n     style=\"display:none\">\n  <pre style=\"white-space: pre-wrap;\">@article{heras2018interaction,\n  title={Interaction between ruthenium oxide surfaces and water molecules. Effect of surface morphology and water coverage},\n  author={Heras-Domingo, Javier and Sodupe, Mariona and Solans-Monfort, Xavier},\n  journal={The Journal of Physical Chemistry C},\n  volume={123},\n  number={13},\n  pages={7786--7798},\n  year={2018},\n  publisher={ACS Publications},\n  doi={10.1021/acs.jpcc.8b06438}\n}\n</pre>\n</div>\n\n\n\n</div>\n\n\n\n\n\n    </div>\n  </div>\n\n\n\n\n  </div>\n\n\n  <!-- Modal -->\n\n  <!-- <iframe id=\"bibbase_network_frame\" -->\n  <!--         src=\"//bibbase.org/network/control\" -->\n  <!--         style=\"display: none;\"> -->\n  <!-- </iframe> -->\n\n</div>\n"}; document.write(bibbase_data.data);