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Dear VASP team,

There are some DFT programs which are capable of producing self-consistent DFT energy with one selected functional and at the same time supply non self-consistent DFT energies in the output for the other functionals which are available for the programs.

ex. If we select PW91 functional for the calculations it also produce non self-cocnsistent energies for say, PBE,RPBE etc.

Is this kind of option is available in the current version of the VASP ? if not, Would it available in future versions ?

thanks in advance

Best regards

Krishna Mohan G P

Theor Chem
University of Leiden

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