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Atomic-orbital Based Ab-initio Computation at UStc
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ModuleESolver::ESolver_KS Member List

This is the complete list of members for ModuleESolver::ESolver_KS, including all inherited members.

after_all_runners(UnitCell &ucell) overrideModuleESolver::ESolver_KSvirtual
after_scf(UnitCell &ucell, const int istep, const bool conv_esolver) overrideModuleESolver::ESolver_KSprotectedvirtual
basisnameModuleESolver::ESolver_KSprotected
before_all_runners(UnitCell &ucell, const Input_para &inp) overrideModuleESolver::ESolver_KSvirtual
before_scf(UnitCell &ucell, const int istep) overrideModuleESolver::ESolver_KSprotectedvirtual
cal_energy()=0ModuleESolver::ESolverpure virtual
cal_force(UnitCell &ucell, ModuleBase::matrix &force)=0ModuleESolver::ESolverpure virtual
cal_stress(UnitCell &ucell, ModuleBase::matrix &stress)=0ModuleESolver::ESolverpure virtual
CEModuleESolver::ESolver_FPprotected
chrModuleESolver::ESolver_FPprotected
classnameModuleESolver::ESolver
conv_esolverModuleESolver::ESolver
dftuModuleESolver::ESolver_KSprotected
diag_ethrModuleESolver::ESolver_KSprotected
drhoModuleESolver::ESolver_KSprotected
ESolver()ModuleESolver::ESolverinline
ESolver_FP()ModuleESolver::ESolver_FP
ESolver_KS()ModuleESolver::ESolver_KS
esolver_KS_neModuleESolver::ESolver_KSprotected
hamilt2rho(UnitCell &ucell, const int istep, const int iter, const double ethr)ModuleESolver::ESolver_KSprotected
hamilt2rho_single(UnitCell &ucell, const int istep, const int iter, const double ethr)ModuleESolver::ESolver_KSprotectedvirtual
hsolver_errorModuleESolver::ESolver_KSprotected
iter_finish(UnitCell &ucell, const int istep, int &iter, bool &conv_esolver) overrideModuleESolver::ESolver_KSprotectedvirtual
iter_init(UnitCell &ucell, const int istep, const int iter)ModuleESolver::ESolver_KSprotectedvirtual
iter_timeModuleESolver::ESolver_FPprotected
kvModuleESolver::ESolver_FPprotected
locppModuleESolver::ESolver_FPprotected
maxniterModuleESolver::ESolver_KSprotected
niterModuleESolver::ESolver_KSprotected
oscillate_esolverModuleESolver::ESolver_KSprotected
others(UnitCell &ucell, const int istep)ModuleESolver::ESolverinlinevirtual
p_chgmixModuleESolver::ESolver_KSprotected
p_hamiltModuleESolver::ESolver_KSprotected
pelecModuleESolver::ESolver_FPprotected
PgridModuleESolver::ESolver_FPprotected
ppcellModuleESolver::ESolver_KSprotected
pw_bigModuleESolver::ESolver_FPprotected
pw_rhoModuleESolver::ESolver_FPprotected
pw_rho_flagModuleESolver::ESolver_FPprotected
pw_rhodModuleESolver::ESolver_FPprotected
pw_wfcModuleESolver::ESolver_KSprotected
runner(UnitCell &ucell, const int istep) overrideModuleESolver::ESolver_KSvirtual
scf_ene_thrModuleESolver::ESolver_KSprotected
scf_nmax_flagModuleESolver::ESolver_KSprotected
scf_thrModuleESolver::ESolver_KSprotected
sfModuleESolver::ESolver_FPprotected
solventModuleESolver::ESolver_FPprotected
~ESolver()ModuleESolver::ESolverinlinevirtual
~ESolver_FP()ModuleESolver::ESolver_FPvirtual
~ESolver_KS()ModuleESolver::ESolver_KSvirtual