[CP2K-user] [CP2K:17556] Generalized vibrational density of states
Dev Rana
dev.rana3 at gmail.com
Fri Aug 26 21:45:13 UTC 2022
Hello,
Does anyone know if CP2K can output generalized vibrational density of
states for correlating to inelastic neutron scattering spectra? Or how a
conversion can be made from either DOS or PDOS from CP2K?
This might be a simple or complex question - I'm still fairly new and I am
not sure.
Thank you,
Devyesh Rana
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