SaX: An open source package for electronic-structure and optical-properties calculations in the GW approximation

Computer Physics Communications

Volumn 180, Issue 8, 2009, Pages 1416-1425

  Martin Samos, Layla ^a,b   Bussi, Giovanni ^b,c  

^a NanoStructures and bioSystems at Surfaces ^*  (Italy)

^b UNIVERSITY OF MODENA AND REGGIO EMILIA   (Italy)

^c ETH ZURICH   (Switzerland)

Author keywords

Bethe Salpeter; Electronic properties; GW self energy; Object oriented programming; Optical properties; Plane waves

Indexed keywords

A-PLANE; BASIS SETS; BETHE-SALPETER; BETHE-SALPETER EQUATION; CATALOGUE IDENTIFIERS; CELL VOLUME; COMPUTATIONAL TIME; DATA ABSTRACTION; DISTRIBUTED PROGRAM; ELECTRONIC BAND-STRUCTURE; ELECTRONIC TRANSITION; EXCITONIC EFFECT; FORTRAN; GNU GENERAL PUBLIC LICENSE; GW APPROXIMATION; GW SELF-ENERGY; IN-PLANE; IRELAND; LARGE SYSTEM; LINUX CLUSTERS; LINUX PC; MATRIX; MEMORY ALLOCATION; MESSAGE PASSING INTERFACE; METALLIC SYSTEMS; NONLOCAL; NORM-CONSERVING PSEUDOPOTENTIALS; OBJECT ORIENTED; OPEN SOURCE PACKAGE; OPEN SOURCES; OPERATING SYSTEMS; PARALLEL COMPUTATION; PLANE-WAVES; PROGRAMMING LANGUAGE; QUASI PARTICLES; RUNNING TIME; SELF ENERGY; SOLUTION METHODS; STATE OF THE ART; SYSTEM COMPLEXITY; TEST DATA;

CELL MEMBRANES; COBOL (PROGRAMMING LANGUAGE); COMPUTER OPERATING SYSTEMS; ELECTRON MOBILITY; ELECTRONIC PROPERTIES; FORTRAN (PROGRAMMING LANGUAGE); LIGHT POLARIZATION; MATHEMATICAL OPERATORS; MESSAGE PASSING; OBJECT ORIENTED PROGRAMMING; SET THEORY; STRUCTURAL PROPERTIES; TEST FACILITIES;

OPTICAL PROPERTIES;

EID: 67651083712     PISSN: 00104655     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cpc.2009.02.005     Document Type: Article

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