Alphabetical list of available ULHPC software belonging to the 'phys' category. To load a software of this category, use: module load phys/<software>[/<version>]

Software Versions Swsets Architectures Clusters Description
Elk 6.3.2, 7.0.12 2019b, 2020b broadwell, skylake, epyc iris, aion An all-electron full-potential linearised augmented-plane wave (FP-LAPW) code with many advanced features. Written originally at Karl-Franzens-Universit├Ąt Graz as a milestone of the EXCITING EU Research and Training Network, the code is designed to be as simple as possible so that new developments in the field of density functional theory (DFT) can be added quickly and reliably.
FDS 6.7.1, 6.7.6 2019b, 2020b broadwell, skylake, epyc iris, aion Fire Dynamics Simulator (FDS) is a large-eddy simulation (LES) code for low-speed flows, with an emphasis on smoke and heat transport from fires.
Meep 1.4.3 2019b broadwell, skylake iris Meep (or MEEP) is a free finite-difference time-domain (FDTD) simulation software package developed at MIT to model electromagnetic systems.
UDUNITS 2.2.26 2019b, 2020b broadwell, skylake, gpu, epyc iris, aion UDUNITS supports conversion of unit specifications between formatted and binary forms, arithmetic manipulation of units, and conversion of values between compatible scales of measurement.
VASP 5.4.4, 6.2.1 2019b, 2020b broadwell, skylake, epyc, gpu iris, aion The Vienna Ab initio Simulation Package (VASP) is a computer program for atomic scale materials modelling, e.g. electronic structure calculations and quantum-mechanical molecular dynamics, from first principles.

Last update: July 19, 2024