Open AccessSubsystem density-functional theory: A reliable tool for spin-density based properties
Author(s) -
Patrick Eschenbach,
Johannes Neugebauer
Publication year - 2022
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/5.0103091
Subject(s) - density functional theory , orbital free density functional theory , open shell , functional theory , computer science , spin (aerodynamics) , a priori and a posteriori , spin density , ab initio , set (abstract data type) , function (biology) , wave function , statistical physics , time dependent density functional theory , computational chemistry , physics , quantum mechanics , chemistry , thermodynamics , condensed matter physics , philosophy , epistemology , evolutionary biology , biology , programming language
Accelerating Research
Robert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom
Address
John Eccles HouseRobert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom