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Parallel Quantum Solution


[edit] Access

The server is cmms12.cmms.pitt.edu and jobs are submitted to the xeon queue through Torque PBS.


[edit] Resources

  • This machine has 4 dual Xeon CPU nodes and can be used for serial or parallel jobs.
  • Each node has one large scratch disk 
/scr 170 GB; 2 GBytes of RAM.


[edit] Software

Mandrake Linux 9.2
Intel C and Fortran compilers
Torque/MAUI
SunGrid Engine
Gaussian03
Parallel Quantum Solutions (PQS)
GAMESS
Molden
SAPT
TURBOMOLE
ADF-DFT
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