Applications: Difference between revisions

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<pre>
<pre>
[jsmith@hpc10 ~]$ module avail
[feverdij@hpc12:~]$ module avail


------------------------ /usr/share/Modules/modulefiles ------------------------
-------------------------------------------------- /usr/share/Modules/modulefiles --------------------------------------------------
dot        module-git  module-info modules    null        use.own
dot        module-git  module-info modules    null        use.own


------------------------------- /etc/modulefiles -------------------------------
--------------------------------------------------------- /etc/modulefiles ---------------------------------------------------------
mpi/openmpi-x86_64
mpi/openmpi-x86_64


------------------------ /opt/ud/LOCAL/etc/modulefiles -------------------------
-------------------------------------------------- /opt/ud/LOCAL/etc/modulefiles ---------------------------------------------------
abaqus/6.14             gromacs/5.1.2           omni3d/5.5
abaqus/2019                      edem/2018                        nastran/2014.1
adf/2016.103            intel/2013sp1          openfoam/2.2.2
abaqus/2021(default)            eman/2.12                        nastran/2014.1_sdk
ansys/16.0             intel/2016              openfoam/2.4.0
abaqus/6.14                     eman/2.2                        nastran/2018.2.1
ansys/17.1             libctl/3.2.2           openfoam/3.0.1
adf/2016.103                    eman/2.21                        nastran/2019
ansys/17.2             LOCAL                  openfoam/4.1
ams/2020.101                    eman/2.31                        nastran/2019_fp1
bader/0.28a             matlab/2015a            patran/2010r1
ams/2021.102                    emspring/0.86.1661              nastran/2020
biogeme/2.4             matlab/2016b            petsc/petsc-3.6.2
ansys/18.1                      FDTD/8.15.758                    numeca/2015-01
comsol/50              matplotlib/1.5.1       phonopy/1.10.8
ansys/19.1                      finemarine/5.1                  omni3d/5.5
comsol/51               maui/3.3.1             povray/3.7
ansys/2019r1                    fsl/5.0.9                        openfoam/2.2.2
comsol/52              meep/1.3               sinfo/0.0.48
ansys/2019r2                    geopsypack/2.9.0                 openfoam/2.4.0
cuda/7.0                mpi/openmpi-1.8.8-gnu  spinw/5.5
ansys/2019r3                    gromacs/5.1.2                   openfoam/3.0.1
dipimage/2.8            mpi/openmpi-1.8.8-intel tecplot/2015R1
ansys/2020r1                    imod/4.9.2                       openfoam/4.1
FDTD/8.15.758          nastran/2010r1          torque/4.2.10
bader/0.28a                     intel/10.1                      openfoam/v2006
finemarine/5.1          nastran/2014.1         vasp/5.3.5-vtst
biogeme/2.4                     intel/11.1                      peet/1.11.1
fsl/5.0.9               nastran/2016.1.1        vasptest/5.4.1
chimera/1.11.2                  intel/2013sp1                    petsc/petsc-3.6.2
geopsypack/2.9.0        numeca/2015-01          vsaero/7.7
cistem/1.0.0-beta                intel/2016                      phenix/1.13
comsol/53a                      intel/2017u4                    phonopy/1.10.8
comsol/54                        intel/2018u1                    povray/3.7
comsol/55(default)               intel/2018u2                    relion/2.0.5
comsol/56                        intel/2018u3                    relion/2.1
convergecfd/hpcx/3.0.19          intel/2019u2                    relion/2.1.0
convergecfd/intelmpi/3.0.19      intel/oneapi_2021u2             relion/2.1b1
convergecfd/intelmpi_2018/3.0.19 lammps/29Oct20                  samcef/2021.2i8
convergecfd/mpich/3.0.19        libctl/3.2.2                    scipion/1.0.1
convergecfd/openmpi/3.0.19      LOCAL                            scipion/1.1
ctffind/4.1.8                    matlab/2017b                    sinfo/0.0.48
cuda/10.2                        matlab/2018a                    spinw/5.5
cuda/11.2(default)              matlab/2019b                    starccm+/2021.1.1
cuda/7.0                        matlab/2020a(default)            tecplot/2015R1
cuda/7.5                        matlab/2020b                    tecplot/2017R2
cuda/8.0                        matplotlib/1.5.1                tecplot_for_converge/2020.1.0
cuda/9.2                        matplotlib/2.0.2                torque/4.2.10
devtoolset/10                    maui/3.3.1                       vasp/5.3.5-vtst
devtoolset/6                    meep/1.3                        vasptest/5.4.1
devtoolset/8(default)            meep/1.5                        vsaero/7.7
devtoolset/9                    motioncor2/1.0                   vsaero/7.9
dipimage/2.8                    motioncor2/1.0.5                vsaero/8.0
dipimage/2.9                     mpi/openmpi-1.8.8-gnu
edem/2017                        mpi/openmpi-1.8.8-intel
</pre>
</pre>


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  module load matlab
  module load matlab


There are two verions of Matlab available, the command above selects the highest version (2016b). If for some reason you want to use the older version, type:
There are two versions of Matlab available, the command above selects the highest version (2016b). If for some reason you want to use the older version, type:


  module load matlab/2015a
  module load matlab/2015a
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Please note that not all applications that are available will actually work, some of them can only work on a few specific hpc clusters due to license restrictions.
Please note that not all applications that are available will actually work, some of them can only work on a few specific hpc clusters due to license restrictions.
For example, software exclusive for the HPC12 is Numeca, Abaqus, Vsaero, Convergence CFD and Simcenter Samcef

Revision as of 09:13, 14 September 2021

There are a number of applications or software packages that can be used on the hpc clusters. To see what's available type:

module avail

The output will look like this:

[feverdij@hpc12:~]$ module avail

-------------------------------------------------- /usr/share/Modules/modulefiles --------------------------------------------------
dot         module-git  module-info modules     null        use.own

--------------------------------------------------------- /etc/modulefiles ---------------------------------------------------------
mpi/openmpi-x86_64

-------------------------------------------------- /opt/ud/LOCAL/etc/modulefiles ---------------------------------------------------
abaqus/2019                      edem/2018                        nastran/2014.1
abaqus/2021(default)             eman/2.12                        nastran/2014.1_sdk
abaqus/6.14                      eman/2.2                         nastran/2018.2.1
adf/2016.103                     eman/2.21                        nastran/2019
ams/2020.101                     eman/2.31                        nastran/2019_fp1
ams/2021.102                     emspring/0.86.1661               nastran/2020
ansys/18.1                       FDTD/8.15.758                    numeca/2015-01
ansys/19.1                       finemarine/5.1                   omni3d/5.5
ansys/2019r1                     fsl/5.0.9                        openfoam/2.2.2
ansys/2019r2                     geopsypack/2.9.0                 openfoam/2.4.0
ansys/2019r3                     gromacs/5.1.2                    openfoam/3.0.1
ansys/2020r1                     imod/4.9.2                       openfoam/4.1
bader/0.28a                      intel/10.1                       openfoam/v2006
biogeme/2.4                      intel/11.1                       peet/1.11.1
chimera/1.11.2                   intel/2013sp1                    petsc/petsc-3.6.2
cistem/1.0.0-beta                intel/2016                       phenix/1.13
comsol/53a                       intel/2017u4                     phonopy/1.10.8
comsol/54                        intel/2018u1                     povray/3.7
comsol/55(default)               intel/2018u2                     relion/2.0.5
comsol/56                        intel/2018u3                     relion/2.1
convergecfd/hpcx/3.0.19          intel/2019u2                     relion/2.1.0
convergecfd/intelmpi/3.0.19      intel/oneapi_2021u2              relion/2.1b1
convergecfd/intelmpi_2018/3.0.19 lammps/29Oct20                   samcef/2021.2i8
convergecfd/mpich/3.0.19         libctl/3.2.2                     scipion/1.0.1
convergecfd/openmpi/3.0.19       LOCAL                            scipion/1.1
ctffind/4.1.8                    matlab/2017b                     sinfo/0.0.48
cuda/10.2                        matlab/2018a                     spinw/5.5
cuda/11.2(default)               matlab/2019b                     starccm+/2021.1.1
cuda/7.0                         matlab/2020a(default)            tecplot/2015R1
cuda/7.5                         matlab/2020b                     tecplot/2017R2
cuda/8.0                         matplotlib/1.5.1                 tecplot_for_converge/2020.1.0
cuda/9.2                         matplotlib/2.0.2                 torque/4.2.10
devtoolset/10                    maui/3.3.1                       vasp/5.3.5-vtst
devtoolset/6                     meep/1.3                         vasptest/5.4.1
devtoolset/8(default)            meep/1.5                         vsaero/7.7
devtoolset/9                     motioncor2/1.0                   vsaero/7.9
dipimage/2.8                     motioncor2/1.0.5                 vsaero/8.0
dipimage/2.9                     mpi/openmpi-1.8.8-gnu
edem/2017                        mpi/openmpi-1.8.8-intel

Now you can choose any of the applications from the list with the module load command. If, for example, you want to use Matlab, type:

module load matlab

There are two versions of Matlab available, the command above selects the highest version (2016b). If for some reason you want to use the older version, type:

module load matlab/2015a

Now you can start Matlab from the commandline:

[jsmith@hpc10 ~]$ matlab
MATLAB is selecting SOFTWARE OPENGL rendering.

                            < M A T L A B (R) >
                  Copyright 1984-2016 The MathWorks, Inc.
                   R2016b (9.1.0.441655) 64-bit (glnxa64)
                             September 7, 2016

 
To get started, type one of these: helpwin, helpdesk, or demo.
For product information, visit www.mathworks.com.
 
>>

If you have an X server running on your PC or laptop and you are logged in using X-forwarding, Matlab should start with a graphical desktop.

Please note that not all applications that are available will actually work, some of them can only work on a few specific hpc clusters due to license restrictions.

For example, software exclusive for the HPC12 is Numeca, Abaqus, Vsaero, Convergence CFD and Simcenter Samcef