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DFT calculations with Quantum ESPRESSO

By Janam Jhaveri1, Ravi Pramod Kumar Vedula1, Alejandro Strachan1, Benjamin P Haley1

1. Purdue University

DFT calculations of molecules and solids

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Version 2.8 - published on 30 Apr 2014

doi:10.4231/D33R0PT4M cite this

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Version Released DOI Handle Published
2.8 30 Apr 2014 doi:10.4231/D33R0PT4M yes
2.7 13 Mar 2014 doi:10.4231/D3G73740Q no
2.6 26 Feb 2014 doi:10.4231/D3N58CM0D no
2.5 24 Feb 2014 doi:10.4231/D3542J84Z no
2.4 27 Sep 2013 doi:10.4231/D3SN0144Z no
2.3 07 May 2013 doi:10.4231/D34M9197T no
2.2 03 Mar 2011 doi:10.4231/D3P55DG7K no
2.1 14 Feb 2011 doi:10.4231/D3KD1QK3P no
2.0 25 Oct 2010 doi:10.4231/D35M62672 no
1.0 15 Jul 2010 doi:10.4231/D3H70807W no, a resource for nanoscience and nanotechnology, is supported by the National Science Foundation and other funding agencies. Any opinions, findings, and conclusions or recommendations expressed in this material are those of the author(s) and do not necessarily reflect the views of the National Science Foundation.