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research:chemistry [2015/10/21 12:05]
kgovender
research:chemistry [2025/12/09 15:27] (current)
alopis
Line 1: Line 1:
-======Chemistry======+======Chemistry and Material Science======
  
-All chemistry and material science users at the CHPC should contact [[mailto:kgovender3@csir.ac.za|Krishna Govender]] or [[mailto:ALopis@csir.co.za|Anton Lopis]] for any related queries.+All chemistry and material science users at the CHPC should contact [[mailto:ALopis@csir.co.za|Anton Lopis]] for any related queries.
 The following codes are supported at the CHPC: The following codes are supported at the CHPC:
-  * [[howto:G09|GAUSSIAN09]]+  * [[howto:COMMERCIAL_CODES]] (**//Gaussian, Materials Studio, Schrodinger//**) 
 +  * **NOT SUPPORTED** [[howto:DISCOVERY_STUDIO|DISCOVERY_STUDIO]] 
 +  * [[howto:AMBER|AMBER14, AMBER18 AND AMBER20]] 
 +  * [[howto:atat|ATAT]] 
 +  * [[howto:CHIMERA|CHIMERA]] 
 +  * [[howto:CP2K|CP2K]] 
 +  * [[howto:dlpoly|DLPOLY]] 
 +  * [[howto:gromacs|GROMACS]] 
 +  * [[howto:LAMMPS|LAMMPS]] 
 +  * [[howto:NAMD|NAMD]] 
 +  * [[howto:NWCHEM|NWCHEM]] 
 +  * [[howto:ORCA|ORCA]] 
 +  * [[howto:quantum_espresso|QUANTUM_ESPRESSO]] 
 +  * [[howto:vasp|VASP]] 
 +  * [[howto:VMD|VMD]] 
 + 
 +  
  
  
/app/dokuwiki/data/attic/research/chemistry.1445421914.txt.gz · Last modified: 2021/12/09 16:42 (external edit)