SQUIDにインストールされているソフトウェア、ライブラリの一覧です。多くの場合、ソフトウェア、ライブラリを利用する前に対応したモジュールをロードする必要があります。詳細は各ソフトウェアの個別の利用方法解説ページをご参照ください(ソフトウェア名からアクセス可能です)。モジュールコマンドの使い方・仕組みについてはこちらをご参照ください。
The following list is software and library installed on SQUID. Please note that we do not set a path for most of these. Before you use the software and library, you need to load the modules in most of the case. Please see this page for a detail of module command.
Product name | Version | Module name | |||
---|---|---|---|---|---|
for frontend | for CPU | for GPU | for Vector | ||
Anaconda | 2020.11 | no module | |||
AVS/Express Developer | 8.5 | AVSExpress/8.5 | |||
NcView | 2.1.8 | no module | |||
IDL | 8.8 | IDL/8.8 | |||
Gnuplot | 5.2.4 | no module | |||
ImageMagick | 6.9.10-86 Q16 | no module | |||
ParaView | 5.8.1 | ParaView/5.8.1 | |||
Relion | 3.1.1 | relion/3.1.1 | |||
VisIt | 3.1.3 | VisItv/3.1.3 | |||
Gaussian | g16c01 | Gaussian/g16 | |||
g16c02 | Gaussian/g16.g16c02 | Gaussian/g16.g16c02 | |||
ADIOS | 1.13.1 | adios/1.13.1 | |||
GAMESS | v2020.2 | GAMESS/v2020.2 | |||
GROMACS | 2020.3 | gromacs/2020.3 | |||
2021.2 | gromacs/2021.2mpi.GPU | ||||
LAMMPS | 29-Oct-20 | lammps/29-Oct-20 | |||
29-Sep-21 | lammps/29-Sep-21.GPU | ||||
Octave | 5.2.0 | octave/5.2.0 | |||
OpenFORM | v2012 | OpenFOAM/v2012 | |||
ABINIT-MP | 1.22 | abinit-mp/1.22 | abinit-mp/1.22.VEC | ||
HΦ | 3.4.0 | HPhi/3.4.0 | |||
MODYLAS | 1.0.4 | MODYLAS/1.0.4 | |||
NTChem | 12 | NTChem/12.0 | |||
OpenMX | 3.9 | OpenMX/3.9 | |||
Phase/0 | 2020.01 | PHASE0/2020.01 | |||
QuantumESPRESSO | 6.4.1 | QuantumESPRESSO/6.4.1.VEC | |||
SALMON | 2.0.1 | salmon/2.0.1 | |||
SMASH | 2.2.0 | smash/2.2.0 | |||
Intel MKL | 2020update4 | BaseCPU/2023 | |||
NEC Numeric Library Collection | 2.3.0 | BaseVEC/2023 necnlc/2.3.0 |
|||
GNU Scientific Library | 2.5.1 | BaseGCC/2023 | |||
HDF5 | 1.10.5(CPUのみ1.14.1) | BaseCPU/2023 hdf5/1.14.1 |
BaseGPU/2023 hdf5/1.10.5 |
BaseVEC/2023 hdf5/1.10.5 |
|
NetCDF(C) | 4.7.4(CPUのみ4.9.2) | BaseCPU/2023 netcdf-c/4.9.2 |
BaseGPU/2023 netcdf-c/4.7.4 |
BaseVEC/2023 netcdf-c/4.7.4 |
|
NetCDF(CXX) | 4.3.1 | BaseCPU/2023 netcdf-cxx/4.3.1 |
BaseGPU/2023 netcdf-cxx/4.3.1 |
BaseVEC/2023 netcdf-cxx/4.3.1 |
|
NetCDF(fortran) | 4.5.3(CPUのみ4.6.1) | BaseCPU/2023 netcdf-fortran |
BaseGPU/2023 netcdf-fortran |
BaseVEC/2023 netcdf-fortran |
|
Parallel netcdf(C) | 1.12.2(CPUのみ1.12.3) | BaseCPU/2023 pnetcdf-c/1.12.3 |
BaseGPU/2023 pnetcdf-c/1.12.2 |
BaseVEC/2023 pnetcdf-c/1.12.2 |
|
Parallel netcdf(CXX) | 1.12.2(CPUのみ1.12.3) | BaseCPU/2023 pnetcdf-cxx/1.12.3 |
BaseGPU/2023 pnetcdf-cxx/1.12.2 |
BaseVEC/2023 pnetcdf-cxx/1.12.2 |
|
Parallel netcdf(fortran) | 1.12.2(CPUのみ1.12.3) | BaseCPU/2023 pnetcdf-fortran/1.12.3 |
BaseGPU/2023 pnetcdf-fortran/1.12.2 |
pnetcdf-fortran/1.12.2 | |
Keras | 1.0.8 | python3/3.6 | python3/3.6 python3/3.6.GPU | ||
PyTorch | 1.7.0 | python3/3.6 | こちらをご参照ください | ||
TensorFlow | 2.4.0 | python3/3.6 | python3/3.6 python3/3.6.GPU | ||
pbdR | 4.0.3 | R/4.0.3 | |||
Arm Forge | 21.0 | BaseCPU/2023 ArmForge/21.0 |