טוען...
A unified picture of the covalent bond within quantum-accurate force fields: From organic molecules to metallic complexes’ reactivity
Computational studies of chemical processes taking place over extended size and time scales are inaccessible by electronic structure theories and can be tackled only by atomistic models such as force fields. These have evolved over the years to describe the most diverse systems. However, as we impro...
שמור ב:
| הוצא לאור ב: | Sci Adv |
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| Main Authors: | , |
| פורמט: | Artigo |
| שפה: | Inglês |
| יצא לאור: |
American Association for the Advancement of Science
2019
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| נושאים: | |
| גישה מקוונת: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6544456/ https://ncbi.nlm.nih.gov/pubmed/31172029 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1126/sciadv.aaw2210 |
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