modified on 20 September 2017 at 10:15 ••• 18,974 views

Software supporting NWChem

From NWChem

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* '''CULGI''' https://culgi.com/article/culgi-90-embedded-molecular-database
* '''CULGI''' https://culgi.com/article/culgi-90-embedded-molecular-database
*  '''KiSThelP'''  predicts thermodynamic properties and rate constants from NWChem results http://kisthelp.univ-reims.fr/
*  '''KiSThelP'''  predicts thermodynamic properties and rate constants from NWChem results http://kisthelp.univ-reims.fr/
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* '''Chemcraft''' http://www.chemcraftprog.com  
* '''Chemcraft''' http://www.chemcraftprog.com  
* '''ASE''' https://wiki.fysik.dtu.dk/ase
* '''ASE''' https://wiki.fysik.dtu.dk/ase

Revision as of 10:50, 16 November 2016

A variety of programs can display cube files from charge density and ESP and/or use Molden files generated by NWChem

Code that might read NWChem wavefunctions