Software and Libraries
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GPC Software
All the software listed on this page is accessed using a modules system.
To use particular software just load the module (the last column in the following table) as follows.
module load module_name_here
| Software | Version | Comments | Command/Library | Module Name |
|---|---|---|---|---|
| Intel Compiler | 11.1 | icpc,icc,ifort, includes MKL library | intel | |
| GCC Compiler | 4.4.0 | gcc,g++,gfortran | gcc | |
| Openmpi | 1.3.3 | mpicc,mpiCC,mpif77,mpif90 | openmpi | |
| MVAPICH2 | 1.4 | mpicc,mpiCC,mpif77,mpif90 | mvapich2 | |
| Emacs | 23.1 | New version of popular text editor | emacs | emacs |
| Git | 1.6.3 | Revision control system | git,gitk | git |
| Valgrind | 3.4.1 | Memory checking utility | valgrind,cachegrind | valgrind |
| grace | 5.22.1 | Plotting utility | xmgrace | graphics |
| netCDF + udunits | 4.0.1 + 2.1.8 | Scientific data storage and retrieval | ncdump,ncgen,libnetcdf,libudunits2 | netcdf |
| HDF5 | 183-v18 | Scientific data storage and retrieval, parallel I/O | h5ls, h5diff, ..., libhdf5 | hdf5 |
| gsl | 1.13 | GNU Scientific Library | libgsl, libgslcblas | gsl |
| GAMESS (US) | January 12, 2009 R3 | General Atomic and Molecular Electronic Structure System | rungms | gamess |
TCS Software
| Software | Version | Comments | Command/Library | Module Name |
|---|---|---|---|---|
| MPE | -lmpe | mpe |