Last Update:2021/03/05

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Core DevelopersMark van Schilfgaarde (King’s College London)
Target substance/modelMetals, insulators, semiconductors, magnetism, dielectric materials, strongly-correlated electron systems, interface/surface
MethodologyDFT (Density Functional Theory), LDA (Local Density Approximation), LAPW, LMTO, GW method, PMT, quasiparticle self-consistent GW method, DMFT (Dynamical Mean-Field Theory)
Parallelizationk-point parallel calculation is supported.
Related keywords
Otherecalj: A part of the Questaal package is implemented by the ecalj code.