Water-Mediated Proton Hopping Mechanisms at the SnO2(110)/H2O Interface from Ab Initio Deep Potential Molecular Dynamics
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| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
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American Chemical Society
2024-09-01
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| Series: | Precision Chemistry |
| Online Access: | https://doi.org/10.1021/prechem.4c00056 |
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| _version_ | 1850151227377057792 |
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| author | Mei Jia Yong-Bin Zhuang Feng Wang Chao Zhang Jun Cheng |
| author_facet | Mei Jia Yong-Bin Zhuang Feng Wang Chao Zhang Jun Cheng |
| author_sort | Mei Jia |
| collection | DOAJ |
| format | Article |
| id | doaj-art-1fb7bef4f4054d39bcce6a0c5f75b710 |
| institution | OA Journals |
| issn | 2771-9316 |
| language | English |
| publishDate | 2024-09-01 |
| publisher | American Chemical Society |
| record_format | Article |
| series | Precision Chemistry |
| spelling | doaj-art-1fb7bef4f4054d39bcce6a0c5f75b7102025-08-20T02:26:20ZengAmerican Chemical SocietyPrecision Chemistry2771-93162024-09-0121264465410.1021/prechem.4c00056Water-Mediated Proton Hopping Mechanisms at the SnO2(110)/H2O Interface from Ab Initio Deep Potential Molecular DynamicsMei Jia0Yong-Bin Zhuang1Feng Wang2Chao Zhang3Jun Cheng4Henan Key Laboratory of Biomolecular Recognition and Sensing, Henan Joint International Research Laboratory of Chemo/Biosensing and Early Diagnosis of Major Diseases, College of Chemistry and Chemical Engineering, Shangqiu Normal University, Shangqiu, ChinaState Key Laboratory of Physical Chemistry of Solid Surfaces, iChEM, College of Chemistry and Chemical Engineering, Xiamen University, Xiamen, ChinaState Key Laboratory of Physical Chemistry of Solid Surfaces, iChEM, College of Chemistry and Chemical Engineering, Xiamen University, Xiamen, ChinaDepartment of Chemistry-Ångström Laboratory, Uppsala University, Uppsala, SwedenState Key Laboratory of Physical Chemistry of Solid Surfaces, iChEM, College of Chemistry and Chemical Engineering, Xiamen University, Xiamen, Chinahttps://doi.org/10.1021/prechem.4c00056 |
| spellingShingle | Mei Jia Yong-Bin Zhuang Feng Wang Chao Zhang Jun Cheng Water-Mediated Proton Hopping Mechanisms at the SnO2(110)/H2O Interface from Ab Initio Deep Potential Molecular Dynamics Precision Chemistry |
| title | Water-Mediated Proton Hopping Mechanisms at the SnO2(110)/H2O Interface from Ab Initio Deep Potential Molecular Dynamics |
| title_full | Water-Mediated Proton Hopping Mechanisms at the SnO2(110)/H2O Interface from Ab Initio Deep Potential Molecular Dynamics |
| title_fullStr | Water-Mediated Proton Hopping Mechanisms at the SnO2(110)/H2O Interface from Ab Initio Deep Potential Molecular Dynamics |
| title_full_unstemmed | Water-Mediated Proton Hopping Mechanisms at the SnO2(110)/H2O Interface from Ab Initio Deep Potential Molecular Dynamics |
| title_short | Water-Mediated Proton Hopping Mechanisms at the SnO2(110)/H2O Interface from Ab Initio Deep Potential Molecular Dynamics |
| title_sort | water mediated proton hopping mechanisms at the sno2 110 h2o interface from ab initio deep potential molecular dynamics |
| url | https://doi.org/10.1021/prechem.4c00056 |
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