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A working implementation for QuantumESPRESSO v > 7.1 that fully supports `hp.x` and the self-consistent cycle for the ab-initio calculation of Hubbard parameters, both onsite and intersite.
No due date•7/7 issues closed
A working implementation for QuantumESPRESSO v > 7.1 that fully supports `hp.x` and the self-consistent cycle for the ab-initio calculation of Hubbard parameters, both onsite and intersite.