Open AccessA new algorithm for constructing the exchange operator in density-functional-theory calculations using hybrid functionals
Author(s) -
Alan F. Wright
Publication year - 2015
Language(s) - English
Resource type - Reports
DOI - 10.2172/1222447
Subject(s) - density functional theory , operator (biology) , hybrid functional , functional theory , algorithm , computer science , mathematics , algebra over a field , computational chemistry , pure mathematics , chemistry , biochemistry , repressor , transcription factor , gene