pritampanda15/Siesta

FDF files for relaxation, PDOS and Denchar calculations in SIESTA 4.0.2 version as well as 4.1v and PSML supported version

语言：Lua · GitHub 星标：32 · Fork：24

话题：band-structure · denchar · densityofstates · fdf · psml · relaxation · siesta · wavefunction

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