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pro vyhledávání: '"Alexandros Androutsopoulos"'
Autor:
Constantinos Demetriou, Christina Eleftheria Tzeliou, Alexandros Androutsopoulos, Demeter Tzeli
Publikováno v:
Molecules, Vol 28, Iss 24, p 8016 (2023)
Boron presents an important role in chemistry, biology, and materials science. Diatomic transition-metal borides (MBs) are the building blocks of many complexes and materials, and they present unique electronic structures with interesting and peculia
Externí odkaz:
https://doaj.org/article/3c53515663dc4f4faf772ea1f072887f
Publikováno v:
The Journal of chemical physics. 157(5)
In this study, we perform accurate calculations via multireference configuration interaction and coupled cluster methodologies on the dimolybdenum molecule in conjunction with complete series of correlation and weighted core correlation consistent ba
Publikováno v:
The Journal of Chemical Physics. 157:054302
In this study, we perform accurate calculations via multireference configuration interaction and coupled cluster methodologies on the dimolybdenum molecule in conjunction with complete series of correlation and weighted core correlation consistent ba