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what are the requirement input files for band structure calculation in quantum espresso
Asked by rudranarayan khatua @ on • Open • 0
How do I upload open shell molecules with multiplicity?
Asked by Anonymous @ on • Open • 0
Asked by Rodrigo Castillo @ on • Open • 2
Asked by Rajiv Prinja @ on • Open • 0
Is it possible to calculate phonon dispersion here?
Asked by Anonymous @ on • Open • 1
Why are there only three components in the stress tensor?
Asked by Rui Yuan @ on • Open • 1
Is there any way to have a full QE input parameters with this tool ?
Asked by Alice Cooper @ on • Open • 0
How to include spin-polarized calculation in dftqe with this tool?
Asked by Reza Sarhaddi @ on • Open • 0
How to include pseudo potentials in dftqe? How to make usage of parallel nodes?
Asked by penchalaiah.palla @ on • Open • 0