Software Name, Version, Module File, System A, System B/C, System G, Cloud System, Note
## rpm,,,,,,,
GCC, 8.5.0, none, +, +, +, +, RHEL RPM
Python2,2.7, none, +, +, +, +," <a href=""software/python"">Manual</a>"
Python3,3.6, none, +, +, +, +," <a href=""software/python"">Manual</a>"
Python3,3.8, none, +, +, +, +," <a href=""software/python"">Manual</a>"
Python3,3.11, none, +, +, +, +," <a href=""software/python"">Manual</a>"
gnuplot, 5.2.4, none, +, +, +, +, RHEL RPM
CMake,3.26.5, none, +, +, +, +, RHEL RPM
R,4.3.3, none, +, +, +, +, EPEL RPM
Apptainer,1.3.0, none, +, +, +, +, EPEL RPM (旧名称:singularity)
Paraview, 5.9.1, none, +, +, +, +, EPEL RPM
GMT,6.1.0, none, +, +, +, +, EPEL RPM
## common
julia, 1.8.5, julia/1.8.5, +, +, +, +,
## ISV
Gaussian16, c02, gaussian16/c02, +, +, +, -,
GaussView6,6.1.1, gaussian16/c02, +, +, +, -,
Gaussian16, c01, gaussian16/c01, +, +, +, -,
Gaussian9, e01, gaussian9/e01, +, +, +, -,
ENVI, 5.6.3, envi/5.6.3, -, AU, AU, -,
ENVI,6.0.0, envi/6.0.0, -, AU, AU, -,
IDL, 8.8.3, idl/8.8.3, -, AU, AU, -,
IDL,9.0.0, idl/9.0.0, -, AU, AU, -,
Tecplot360, 2022R1, tecplot360/2022R1, -, KU, KU, -,
Tecplot360, 2022R2, tecplot360/2022R2, -, KU, KU, -,
Maple,2022, maple/2022.0, -, KU, KU, -,
Maple,2023, maple/2023.0, -, KU, KU, -,
Maple,2024, maple/2024.0, -, KU, KU, -,
MATLAB, R2023a, matlab/R2023a, -, KU, KU, -,
MSC Nastran,2022.3, nastran/2022.3, -, AU, AU, -,
MSC Nastran,2023.2, nastran/2023.2, -, AU, AU, -,
MSC Nastran,2023.4, nastran/2023.4, -, AU, AU, -,
MSC Patran,2022.3, patran/2022.3, -, AU, AU, -,
MSC Patran,2023.2, patran/2023.2, -, AU, AU, -,
MSC Patran,2023.4, patran/2023.4, -, AU, AU, -,
MSC Marc,2022.3, marc/2022.3, -, AU, AU, -,
MSC Marc,2023.2, marc/2023.2, -, AU, AU, -,
MSC Marc,2023.4, marc/2023.4, -, AU, AU, -,
MSC Marc Mentat,2022.3, marc/2022.3, -, AU, AU, -,
MSC Marc Mentat,2023.2, marc/2023.2, -, AU, AU, -,
MSC Marc Mentat,2023.4, marc/2023.4, -, AU, AU, -,
MSC Adams, 2022.3.1, adams/2022.3.1, -, AU, AU, -,
MSC Adams,2023.2, adams/2023.2, -, AU, AU, -,
MSC Adams,2023.4, adams/2023.4, -, AU, AU, -,
LS-DYNA,R13.1.1, ls-dyna/R13.1.1, -, AU, AU, -,
LS-DYNA,R14.1.0, ls-dyna/R14.0.0, -, AU, AU, -,
Mathematica, 13.1.0, mathematica/13.1.0, -, KU, KU, -,
Mathematica, 13.3.0, mathematica/13.3.0, -, KU, KU, -,
Mathematica, 14.0.0, mathematica/14.0.0, -, KU, KU, -,
ANSYS, 2022R2, ansysmcfd/2022R2, -, KU, KU, -,
ANSYS, 2022R2.2, ansysmcfd/2022R2.2, -, KU, KU, -,
ANSYS, 2023R1.4, ansysmcfd/2023R1.4, -, KU, KU, -,
ANSYS, 2024R1.1, ansysmcfd/2024R1.1, -, KU, KU, -,
AVS, 8.5.1, avs/8.5.1, -, AU, AU, -,
LS-PREPOST, 4.9.10, ls-prepost/4.9.10, -, AU, AU, -,
LS-PREPOST, 4.10.5, ls-prepost/4.10.5, -, AU, AU, -,
## Num Lib
NAG Fortran Library, Mark 26, nag_fortran/26, -, +, -, -,
NAG MPI Parallel Library, Release 3, nag_paralell/3, -, +, -, -,
IMSL FORTRAN NUMERICAL LIBRARY, 2022.1.0, imsl/fnl-2022.1.0, -, +, -, -,
## compiler
Intel oneAPI,2018.4, intel/2018.4, +, +, -, +,
Intel oneAPI,2022.3, intel/2022.3, +, +, -, +,
Intel oneAPI,2023.1, intel/2023.1, +, +, -, +,
Intel oneAPI,2023.2, intel/2023.2, +, +, -, +,
Intel oneAPI,2024.0, intel/2024.0, +, +, -, +,
Intel MPI,2018.4, intelmpi/2018.4, +, +, -, +,
Intel MPI,2022.3, intelmpi/2022.3, +, +, -, +,
Intel MPI,2023.1, intelmpi/2023.1, +, +, -, +,
Intel MPI,2024.0, intelmpi/2024.0, +, +, -, +,
Intel VTune Profiler,2018.4, intel-vtune/2018.4, +, +, -, -,
Intel VTune Profiler,2022.3, intel-vtune/2022.3, +, +, -, -,
Intel VTune Profiler,2023.1, intel-vtune/2023.1, +, +, -, -,
Intel VTune Profiler,2023.2, intel-vtune/2023.2, +, +, -, -,
Intel VTune Profiler,2024.0, intel-vtune/2024.0, +, +, -, -,
Indel Debugger,2022.3, intel-debugger/2022.3, +, +, -, -,
Indel Debugger,2023.1, intel-debugger/2023.1, +, +, -, -,
Indel Debugger,2023.2, intel-debugger/2023.2, +, +, -, -,
Indel Debugger,2024.0, intel-debugger/2024.0, +, +, -, -,
Open MPI, 4.0.5, openmpi/4.0.5_intel-2022.3, +, +, -, +,
Open MPI, 4.1.5, openmpi/4.1.5_intel-2022.3, +, +, -, +,
## ML/DL
MXNet, 1.6.0, mxnet/1.6.0.py38_intel-2022.3, +, +, -, -," <a href=""software/python"">Manual</a>"
PyTorch, 1.13.1, pytorch/1.13.1.py38_intel-2022.3, +, +, -, -," <a href=""software/python"">Manual</a>"
TensorFlow, 2.11.0, tensorflow/2.11.0.py38_intel-2022.3, +, +, -, -," <a href=""software/python"">Manual</a>"
PyTorch, 2.0.1, pytorch/2.0.1.py38_intel-2022.3, +, +, -, -," <a href=""software/python"">Manual</a>"
## python
mpi4py, 3.1.4, mpi4py/3.1.4.py38_intel-2022.3-impi, +, +, -, -," <a href=""software/python"">Manual</a>"
## OSS
ARPACK, 3.9.0, arpack/3.9.0_intel-2022.3-impi, +, +, +, +,
CMake, 3.24.3, cmake/3.24.3_gnu-8.5.0, +, +, +, +,
FFTW, 3.3.10, fftw/3.3.10_intel-2022.3-impi, +, +, +, +,
HDF5, 1.12.2, hdf5/1.12.2_intel-2022.3, +, +, +, +,
HDF5+MPI, 1.12.2, hdf5/1.12.2_intel-2022.3-impi, +, +, +, +,
NETCDF, 4.9.0, netcdf/4.9.0_intel-2022.3, +, +, +, +,
NETCDF+MPI, 4.9.0, netcdf/4.9.0_intel-2022.3-impi, +, +, +, +,
Quantum Espresso,7.1, qe/7.1_intel-2022.3-impi, +, +, +, +,
PETSc, 3.18.0, petsc/3.18.0_intel-2022.3-impi, +, +, -, +,
LAMMPS, 23Jun2022, lammps/23Jun2022_intel-2022.3-impi, +, +, -, +,
GAMESS,2022.2, gamess/2022.2_intel-2022.3-impi, +, +, -, +, Requires 2 core allocations per process.
PLASMA, 19.8.1, plasma/19.8.1_intel-2022.3-impi, +, +, -, +,
SuperLU, 5.3.0, superlu/5.3.0_intel-2022.3, +, +, -, +,
OpenMX,3.9, openmx/3.9_intel-2022.3-impi, +, +, -, +,
Gromacs (double-precision),2022.4, gromacs/2022.4_gnu-12.2.0-impi_dp_mpi, +, +, +, +, GCC+MPI 
Gromacs (double-precision),2022.4, gromacs/2022.4_gnu-12.2.0-impi_dp_smp, +, +, +, +, GCC+SMP
Gromacs (single-precision),2022.4, gromacs/2022.4_gnu-12.2.0-impi_sp_mpi, +, +, +, +, GCC+MPI
Gromacs (single-precision),2022.4, gromacs/2022.4_gnu-12.2.0-impi_sp_smp, +, +, +, +, GCC+SMP
Paraview, 5.11.0, paraview/5.11.0, +, +, +, +, binary distribution
VisIt, 3.3.1, visit/3.3.1_gnu-12.2.0, +, +, +, +,
grads, 2.0.2, grads/2.0.2_intel-2022.3, +, +, +, +, 
grads, 2.2.1, grads/2.2.1_intel-2022.3, +, +, +, +, 
NAMD,2.14, namd/2.14_intel-2022.3-impi, +, +, -, +,
Anaconda3,2022.1, anaconda3/2022.10, +, +, +, +,
AWSCLI, 2.12.3, awscli/2.12.3, +, +, +, +,
CP2K,2023.1, cp2k/2023.1_gnu_12.2.0-impi, -, +, -, +,
LAMMPS, 22Dec2022, lammps/22Dec2022_intel-2022.3-impi, +, +, -, +,
OpenFOAM,2206, openfoam.com/2206_intel-2022.3-impi, +, +, -, +,
OpenFOAM,10, openfoam/10_intel-2022.3-impi, +, +, -, +,
Quantum Espresso,6.1, qe/6.1_intel-2018.0-impi, +, +, +, +,
Quantum Espresso,7.2, qe/7.2_intel-2022.3-impi, +, +, +, +,
R, 4.2.2, r/4.2.2_gnu-12.2.0, -, +, -, +,
#### System G
## compiler
NVIDIA HPC SDK,21.9, nvhpc/21.9, -, -, +, -,
NVIDIA HPC SDK,22.5, nvhpc/22.5, -, -, +, -,
NVIDIA HPC SDK,22.9, nvhpc/22.9, -, -, +, -,
NVIDIA HPC SDK,23.5, nvhpc/23.5, -, -, +, -,
NVIDIA HPC SDK,23.9, nvhpc/23.9, -, -, +, -,
Open MPI, 4.0.5, openmpi/4.0.5_nvhpc-22.5, -, -, +, -,
Open MPI, 4.0.5, openmpi/4.0.5_nvhpc-22.9, -, -, +, -,
Open MPI, 4.1.5, openmpi/4.1.5_nvhpc-23.5, -, -, +, -,
Open MPI, 4.1.5, openmpi/4.1.5_nvhpc-23.9, -, -, +, -,
## OSS
FFTW, 3.3.10, fftw/3.3.10_nvhpc-22.9-ompi, -, -, +, -,
HDF5, 1.12.2, hdf5/1.12.2_nvhpc-22.9, -, -, +, -,
HDF5+MPI, 1.12.2, hdf5/1.12.2_nvhpc-22.9-ompi, -, -, +, -,
NETCDF, 4.9.0, netcdf/4.9.0_nvhpc-22.9, -, -, +, -,
NETCDF+MPI, 4.9.0, netcdf/4.9.0_nvhpc-22.9-ompi, -, -, +, -,
Gromacs (single-precision),2022.4, gromacs/2022.4_gnu-8.5.0_cuda-11.7_ompi_sp_smp, -, -, +, -, GCC+SMP+CUDA
NAMD,2.14, namd/2.14_multicore-cuda, -, -, +, -,
## cuda
CUDA,9.2, cuda/9.2, -, -, +, -,
CUDA, 11.2.1, cuda/11.2.1, -, -, +, -,
CUDA, 11.7.1, cuda/11.7.1, -, -, +, -,
CUDA, 12.1.1, cuda/12.1.1, -, -, +, -,
CUDA,12.2.2, cuda/12.2.2, -, -, +, -,
## ML/DL
MXNet, 1.9.1, mxnet/1.9.1.py38_cuda-11.7, -, -, +, -," <a href=""software/python"">Manual</a>"
PyTorch, 1.13.1, pytorch/1.13.1.py38_cuda-11.7, -, -, +, -," <a href=""software/python"">Manual</a>"
PyTorch,2.0.1, pytorch/2.0.1.py38_cuda-11.7, -, -, +, -," <a href=""software/python"">Manual</a>"
TensorFlow, 2.11.0, tensorflow/2.11.0.py38_cuda-11.2, -, -, +, -," <a href=""software/python"">Manual</a>"
## python
mpi4py, 3.1.4, mpi4py/3.1.4.py38_nhvpc-22.9-ompi, -, -, +, -," <a href=""software/python"">Manual</a>"
cuDNN, 8.1.1.33, cudnn/8.1.1.33_cuda-11.2, -, -, +, -,
cuDNN, 8.6.0.163, cudnn/8.6.0.163_cuda-11.7, -, -, +, -,
cuDNN,8.9.7.29,cudnn/8.9.7.29_cuda-12.x, -, -, +, -,
NCCL, 2.8.4, nccl/2.8.4_cuda-11.2, -, -, +, -,
NCCL, 2.14.3, nccl/2.14.3_cuda-11.7, -, -, +, -,
TensorRT, 7.2.3.4, tensorrt/7.2.3.4_cuda-11.2, -, -, +, -,