Quick Facts
NPACI ROCKS v.5.2.2
Red Hat Enterprise Linux v5.4
Front End: Pentium 4 3.0GHz; 1GB RAM
Compute Nodes:
00-15: Dual Xeon 2.8GHz; 2GB RAM
16-23: Dual Xeon Dual Core 1.86Hz; 4GB RAM
24-31: Dual Xeon Quad Core 2.00Hz; 8GB RAM
If you are having trouble with compiling programs, please send an email to
pandey-AT-mtu-DOT-edu
We may be able to help you out with makefile tips, etc.
Compilers
GNU Compiler Collection
Intel Compilers v9.1.04x
Intel Cluster MKL v9.0.017
Intel MKL v8.0.1
PGI Cluster Dev Kit v6.0.2
MPICH1-2.7p1 (Intel)
Intel Compilers v9.1.04x
Intel Cluster MKL v9.0.017
Intel MKL v8.0.1
PGI Cluster Dev Kit v6.0.2
MPICH1-2.7p1 (Intel)
Computational Suites :: Serial
Crystal 2006
DMol3
Gaussian 98
Gaussian 03
GULP 3.1
DMol3
Gaussian 98
Gaussian 03
GULP 3.1
Computational Suites :: Parallel
SIESTA 1.3-f1p
SIESTA 2.0.1
SMEAGOL 1.0b
VASP 4.6.28
VASP 4.6.31
SIESTA 2.0.1
SMEAGOL 1.0b
VASP 4.6.28
VASP 4.6.31