NERSC logo National Energy Research Scientific Computing Center
  A DOE Office of Science User Facility
  at Lawrence Berkeley National Laboratory
 

Materials Science Software at NERSC

PackagePlatformVersionModule Docs
ABINIT franklin 5.4.4* abinit/5.4 NERSCVendor
ABINIT jacquard 5.4.4* abinit/5.4 NERSCVendor
cpmd bassi 3.11.1* cpmd/3.11.1 NERSCVendor
cpmd franklin 3.11.1* cpmd/3.11.1 NERSCVendor
lammps bassi 2007.07* lammps/2007.07 NERSCVendor
lammps bassi 2008.06* lammps/2008.06 NERSCVendor
lammps franklin 2007.12* lammps NERSCVendor
lammps franklin 2008.06* lammps/2008.06 NERSCVendor
Qbox franklin 1.45.1* qbox NERSCVendor
Quantum Espresso bassi 3.2* espresso/3.2 NERSCVendor
Quantum Espresso bassi 4.0* espresso/4.0 NERSCVendor
Quantum Espresso franklin 4.0* espresso/4.0 NERSCVendor
siesta bassi 2.0.1* siesta/2.0.1 NERSCVendor
siesta franklin 2.0.1* siesta/2.0.1 NERSCVendor
siesta jacquard 2.0.1* siesta/2.0.1 NERSCVendor
vasp bassi 4.6.28 vasp NERSCVendor
vasp bassi 4.6.31 vasp/4.6.31 NERSCVendor
vasp franklin 4.6.28.pkent vasp NERSCVendor
vasp franklin 4.6.31 vasp/4.6.31 NERSCVendor
vasp jacquard 4.6.28 vasp/4.6.28 NERSCVendor
vasp jacquard 4.6.31 vasp NERSCVendor
wien2k bassi 2007.2* wien2k NERSCVendor
(*) Denotes limited support

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