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Are “GAPT Charges” Really Just Charges?
[Image: see text] Generalized atomic polar tensor (GAPT) has turned into a very popular charge model since it was proposed three decades ago. During this period, several works aiming to compare different partition schemes have included it among their tested models. Nonetheless, GAPT exhibits a set o...
المؤلفون الرئيسيون: | , , |
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التنسيق: | Online مقال نص |
اللغة: | English |
منشور في: |
American Chemical
Society
2021
|
الوصول للمادة أونلاين: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8391781/ https://www.ncbi.nlm.nih.gov/pubmed/34324335 http://dx.doi.org/10.1021/acs.jcim.1c00165 |