The many-body expansion approach to ab initio calculation of electric field gradients in molecular crystals
Author(s) -
A. Gregorovič
Publication year - 2020
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.5144735
Subject(s) - methylamine , ethylamine , ab initio , electric field , chemistry , computational chemistry , convergence (economics) , crystal (programming language) , chemical physics , molecular physics , physics , quantum mechanics , computer science , organic chemistry , economics , programming language , economic growth
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