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VASPKIT: A user-friendly interface facilitating high-throughput computing and analysis using VASP code

Vei Wang, Nan Xu, Jincheng Liu, Gang Tang, W. T. Geng

2021Computer Physics Communications7,299 citationsDOIOpen Access PDF

Topics & Concepts

Computer sciencePython (programming language)Scripting languageExecutableComputational scienceUser interfaceInterface (matter)Graphical user interfaceCompilerUser FriendlyData structureFortranThroughputCode generationProgramming languageOperating systemKey (lock)BubbleWirelessMaximum bubble pressure methodHigh-pressure geophysics and materialsElectronic and Structural Properties of OxidesAdvanced Chemical Physics Studies
VASPKIT: A user-friendly interface facilitating high-throughput computing and analysis using VASP code | Litcius