modified on 20 September 2017 at 11:15 ••• 12,843 views

Software supporting NWChem

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(User interface software)
(User interface software)
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* '''ECCE'''  Extensible Computational Chemistry Environment http://ecce.emsl.pnl.gov/ <ref>No longer been actively developed</ref>
* '''ECCE'''  Extensible Computational Chemistry Environment http://ecce.emsl.pnl.gov/ <ref>No longer been actively developed</ref>
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* '''EMSL Arrows''' Evolution of Chemical and Materials Computation http://arrows.pnnl.gov/
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* '''EMSL Arrows''' Evolution of Chemical and Materials Computation http://www.nwchem-sw.org/index.php/EMSL_Arrows
* '''Avogadro''' reads cube files, generates NWChem input files, analyzes output files (including frequencies) http://avogadro.cc
* '''Avogadro''' reads cube files, generates NWChem input files, analyzes output files (including frequencies) http://avogadro.cc
* '''WebMO''' World Wide Web-based interface to computational chemistry packages https://www.webmo.net/ <ref>The WebMo interface might not be compatible with NWChem 6.0 and later versions</ref>
* '''WebMO''' World Wide Web-based interface to computational chemistry packages https://www.webmo.net/ <ref>The WebMo interface might not be compatible with NWChem 6.0 and later versions</ref>

Revision as of 18:47, 16 November 2016

User interface software

  1. No longer been actively developed
  2. The WebMo interface might not be compatible with NWChem 6.0 and later versions

Codes performing post-processing on NWChem wavefunctions

Programs that can display cube files from charge density and ESP and/or use Molden files