"HPC with us" is a collection of on-line resources about running productive computations on Discoverer Petascale Supercomputer, a computer server in the lab, or on your Linux desktop
ABINIT 9.8.2 on Discoverer HPC
ABINIT is a powerful product for calculating variety of optical, mechanical, vibrational, and other observable properties of[…]
Create high productive CP2K 2022.1 build that works on AMD Zen2 microarchitecture
CP2K is a quantum chemistry and solid state physics software package that can perform atomistic simulations of[…]
LLVM 15.0.0 is out (and installed on Discoverer HPC)
The new 15.0.0 version of LLVM compiler infrastructure is out. The source code as well as a[…]
Which FFTW3 build to use on Discoverer
FFTW3 is an important library package that provides large number of HPC applications with a collection of[…]