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pro vyhledávání: '"Jordan J. Philips"'
Publikováno v:
Chemical Physics Letters. 495:146-150
To assess the basis set dependence of different population analysis methods, a comparison of spin populations for five open-shell systems ( CF 2 CCH, C 3 H 7 , CH 2 OH , α-4-dehydrotoluene, and a binuclear Cu complex) was carried out across 13 stand
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::07db357c2854c77976a3e138c1931023
https://doi.org/10.1016/j.cplett.2010.06.046
https://doi.org/10.1016/j.cplett.2010.06.046
