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Searched refs:edispersion (Results 1 – 8 of 8) sorted by relevance

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dkg_energy_corrections.F160 ec_env%edispersion = 0.0_dp
778 ec_env%edispersion = ec_env%edispersion + energy
798 … ec_env%etotal = ec_env%eband + ec_env%ehartree + ec_env%exc - ec_env%vhxc + ec_env%edispersion
805 WRITE (unit_nr, '(T2,A,T16,F16.10)') "Edisp ", ec_env%edispersion
H A Dkg_environment_types.F68 REAL(KIND=dp) :: edispersion component
H A Dqs_dispersion_nonloc.F169 SUBROUTINE calculate_dispersion_nonloc(vxc_rho, rho_r, rho_g, edispersion, & argument
172 REAL(KIND=dp), INTENT(OUT) :: edispersion local
433 edispersion = Ec_nl
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dkg_environment_types.F67 REAL(KIND=dp) :: edispersion component
H A Dec_env_types.F64 REAL(KIND=dp) :: edispersion, efield_nuclear component
H A Denergy_corrections.F231 ec_env%edispersion = 0.0_dp
364 IF (.NOT. calculate_forces) ec_env%edispersion = ec_env%edispersion + edisp
1620 … ec_env%etotal = ec_env%eband + ec_env%ehartree + ec_env%exc - ec_env%vhxc + ec_env%edispersion
1626 WRITE (unit_nr, '(T3,A,T65,F16.10)') "Edisp ", ec_env%edispersion
H A Dqs_dispersion_nonloc.F169 SUBROUTINE calculate_dispersion_nonloc(vxc_rho, rho_r, rho_g, edispersion, & argument
172 REAL(KIND=dp), INTENT(OUT) :: edispersion local
433 edispersion = Ec_nl
/dports/math/R-cran-VGAM/VGAM/man/
H A Ddouble.expbinomial.Rd74 assigning the arguments \code{ldispersion} and \code{edispersion}.