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Searched refs:wttemperature (Results 1 – 6 of 6) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/motion/
H A Dmd_run.F388 force_env%meta_env%wttemperature = simpar%temp_ext
390 dummy = force_env%meta_env%wttemperature*(force_env%meta_env%wtgamma - 1._dp)
402 … + force_env%meta_env%delta_t/force_env%meta_env%wttemperature
/dports/science/cp2k-data/cp2k-7.1.0/src/motion/
H A Dmd_run.F388 force_env%meta_env%wttemperature = simpar%temp_ext
390 dummy = force_env%meta_env%wttemperature*(force_env%meta_env%wtgamma - 1._dp)
402 … + force_env%meta_env%delta_t/force_env%meta_env%wttemperature
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dmetadynamics_types.F109 wtgamma, wttemperature component
H A Dmetadynamics.F932 V_to_fes = 1.0_dp + meta_env%wttemperature*hills_env%invdt_history(ih)
936 ww = wtww*(1.0_dp + meta_env%wttemperature*meta_env%invdt)
1043 …IF (meta_env%well_tempered) dfunc = dfunc/(1.0_dp + meta_env%wttemperature*hills_env%invdt_history…
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dmetadynamics_types.F110 wtgamma, wttemperature component
H A Dmetadynamics.F933 V_to_fes = 1.0_dp + meta_env%wttemperature*hills_env%invdt_history(ih)
937 ww = wtww*(1.0_dp + meta_env%wttemperature*meta_env%invdt)
1044 …IF (meta_env%well_tempered) dfunc = dfunc/(1.0_dp + meta_env%wttemperature*hills_env%invdt_history…