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DFT calculations with Quantum ESPRESSO
DFT calculations of molecules and solids
Version 2.10.1 - published on 14 Aug 2023
doi:10.21981/1RT6-BB82 cite this
This tool is closed source.
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773 |
raman simulation Proposed by Rodrigo Castillo @ on • |
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738 |
Adding GW corrections using GWL package of Quantum Espresso Proposed by Sayan Roy @ on • |
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511 |
Paste input file from client , or load Quantum espresso from a pwscf input just like PWGUI. Proposed by Alice Cooper @ on • |
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351 |
Update with latest available version 4.3 or atleast with 4.2.1 Proposed by penchalaiah.palla @ on • |