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quantum-espresso/test-suite/QEHeat_translation
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Riccardo Bertossa 5e3fadd7ec renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
..
README renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
benchmark.out.git.inp=input.in renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
benchmark.out.git.inp=input_2pt.in renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
benchmark.out.git.inp=input_ar.in renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
benchmark.out.git.inp=input_ar_2pt.in renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
input.in renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
input_2pt.in renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
input_ar.in renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00
input_ar_2pt.in renamed energy_current to QEHeat 2021-05-20 22:52:29 +02:00

README 

the coordinates went throw a pw relax calculation.
If the forces are zero, the energy current must be total_energy * velocity