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Journal of Chemical Physics

Volumn 115, Issue 4, 2001, Pages 1661-1669

Ab initio simulation of charged slabs at constant chemical potential

(4) Lozovoi, A Y a,b Alavi, A b Kohanoff, J a Lynden Bell, R M a

a QUEEN'S UNIVERSITY BELFAST (United Kingdom)

b UNIVERSITY OF CAMBRIDGE (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

BOUNDARY CONDITIONS; CARRIER CONCENTRATION; COMPUTER SIMULATION; ELECTRIC FIELDS; ELECTROCHEMISTRY; ELECTRONIC STRUCTURE; FERMI LEVEL; FREE ENERGY; POISSON EQUATION; TEMPERATURE;

DENSITY FUNCTIONAL THEORY; ELECTRON CHEMICAL POTENTIAL; ELECTRONEUTRALITY; THERMODYNAMIC POTENTIAL;

ELECTRONS;

EID: 0035933991 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1379327 Document Type: Article

Times cited : (225)

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