Article ; Online: DFT study of common anions adsorption at graphene surface due to anion-π interaction.
2022 Volume 28, Issue 8, Page(s) 225
Abstract: Using density functional theory (DFT) calculations, we researched the different anions adsorption on the graphene and found that anions can be stably adsorbed on the graphene surface due to the anion-π interaction. The adsorption energy decreased as the ... ...
Abstract | Using density functional theory (DFT) calculations, we researched the different anions adsorption on the graphene and found that anions can be stably adsorbed on the graphene surface due to the anion-π interaction. The adsorption energy decreased as the order of HPO |
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Language | English |
Publishing date | 2022-07-20 |
Publishing country | Germany |
Document type | Journal Article |
ZDB-ID | 1284729-X |
ISSN | 0948-5023 ; 1610-2940 |
ISSN (online) | 0948-5023 |
ISSN | 1610-2940 |
DOI | 10.1007/s00894-022-05218-4 |
Database | MEDical Literature Analysis and Retrieval System OnLINE |
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