Open AccessDensity functional studies: First principles and semi-emperical calculations of clusters and surfaces
Author(s) -
Susan B. Sinnott
Publication year - 1993
Publication title -
osti oai (u.s. department of energy office of scientific and technical information)
Language(s) - English
Resource type - Reports
DOI - 10.2172/10194540
Subject(s) - density functional theory , relaxation (psychology) , surface (topology) , electronic structure , tetrahedron , transition metal , materials science , chemical physics , statistical physics , chemistry , computational chemistry , physics , crystallography , mathematics , geometry , psychology , social psychology , biochemistry , catalysis
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