subroutine check_real_space_hubbard_input() use SystemData, only: tReltvy, tUEG, tUEG2, tHub, & tKPntSym, tLatticeGens, tUEGNewGenerator, & tGenHelWeighted, tGen_4ind_weighted, tGen_4ind_reverse, & tUEGNewGenerator, tGen_4ind_part_exact, & tGen_4ind_2, tGen_4ind_2_symmetric, tGen_4ind_unbound, tStoreSpinOrbs, & tReal use OneEInts, only: tcpmdsymtmat, tOneelecdiag character(*), parameter :: this_routine = "check_real_space_hubbard_input" ! do all the input checking here, so no wrong input is used! if (tReltvy) call stop_all(this_routine, "tReltvy set to true!") ! what else.. if (tUEG) call stop_all(this_routine, "tUEG set to true!") if (tUEG2) call stop_all(this_routine, "tUEG2 set to true!") if (tHub) call stop_all(this_routine, "tHub set to true!") if (tReal) call stop_all(this_routine, "tReal set to true!") if (tKPntSym) call stop_all(this_routine, "tKPntSym set to true!") if (tLatticeGens) call stop_all(this_routine, "tLatticeGens set to true!") if (tUEGNewGenerator) call stop_all(this_routine, "tUEGNewGenerator set to true!") if (tGenHelWeighted) call stop_all(this_routine, "tGenHelWeighted") if (tGen_4ind_weighted) call stop_all(this_routine, "tGen_4ind_weighted") if (tGen_4ind_reverse) call stop_all(this_routine, "tGen_4ind_reverse") if (tGen_4ind_part_exact) call stop_all(this_routine, "tGen_4ind_part_exact") if (tGen_4ind_2) call stop_all(this_routine, "tGen_4ind_2") if (tGen_4ind_2_symmetric) call stop_all(this_routine, "tGen_4ind_2_symmetric") if (tGen_4ind_unbound) call stop_all(this_routine, "tGen_4ind_unbound") if (tStoreSpinOrbs) call stop_all(this_routine, "tStoreSpinOrbs") if (tcpmdsymtmat) call stop_all(this_routine, "tcpmdsymmat") if (tOneelecdiag) call stop_all(this_routine, "tOneelecdiag") if (any(t_anti_periodic) .and. t_twisted_bc) & call stop_all(this_routine, "anti-periodic and twisted BCs not compatible!") if (tHPHF .and. t_uniform_excits .and. t_trans_corr_hop) then call stop_all(this_routine, "HPHF, transcorr and uniform excits is broken") end if end subroutine check_real_space_hubbard_input