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Structures and Electronic Properties of Cu 3 O n ( n = 1–6) Clusters using ab initio Monte Carlo Simulations
Author(s) -
Bae GyunTack
Publication year - 2016
Publication title -
bulletin of the korean chemical society
Language(s) - Uncategorized
Resource type - Journals
SCImago Journal Rank - 0.237
H-Index - 59
ISSN - 1229-5949
DOI - 10.1002/bkcs.10735
Subject(s) - ab initio , electronic structure , cluster (spacecraft) , density functional theory , monte carlo method , basis set , atomic physics , ab initio quantum chemistry methods , chemistry , ionization energy , molecular physics , ionization , computational chemistry , physics , molecule , ion , statistics , mathematics , organic chemistry , computer science , programming language