v20.05.1 (cloud)

Quantum Mobile Workhorse Server 20.05.0 is the first release with pre-built images on major cloud platforms:

Platform

Pre-built image

Instructions

Amazon Web Services

ami-006638a0a99849fc3

Launch VM

Google Cloud Platform

quantum-mobile-20-05-0

Launch VM

Version Summary

  • OS: Ubuntu 18.04.4 LTS

  • tools: atomistic (xcrysden, jmol, cif2cell, ase, pymatgen, seekpath, spglib, pycifrw), visualization (grace, gnuplot, matplotlib, bokeh, jupyter), simulation environment (slurm, OpenMPI, FFT/BLAS/LAPACK, gcc, gfortran, singularity)

  • simulation codes:

    • Quantum ESPRESSO v6.5

    • yambo v4.5.1

    • fleur v0.30 MaXR4

    • siesta v4.1-rc1

    • cp2k v7.1

    • wannier90 v3.1

    • bigdft 1.9.0

  • aiida v1.1.1

    • aiida-cp2k v1.0.0b6

    • aiida-quantumespresso v3.0.0a6

    • aiida-siesta v1.0.0

    • aiida-fleur v1.0.0a0

    • aiida-bigdft v0.1.0a0

    • aiida-yambo v1.0.0

    • aiida-wannier v2.0.1

    • aiida-wannier-workflows v1.0.1

  • pseudopotentials

    • SSSP (PBE) accuracy v1.1

    • SSSP (PBE) precision v1.1

    • SG15 ONCV v1.1