# filelist

dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/loprop_util
filetypes: fffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  check_bond.f/compute_xhole_int.f/coretopoint.f/cutoff_error.f/desymmetrize.f/diff_aux1.f/diff_mothergoose.f/diff_numerical.f/diff_thrsmul.f/elpointpot.f/epotpoint.f/error_for_t.f/find_dipole_center.f/get_density_matrix.f/golden.f/golden2.f/gramschmidt.f/infotomp.f/init_loprop.f/levmarquart.f/local_properties.f/local_xhole.f/localize_loprop.f/localize_loprop_drv.f/loprop.f/loprop_print.f/lowdin_lp.f/min_mult_error.f/mnbrak.f/mnbrak2.f/move_ec.f/move_prop.f/move_xhole.f/multipole_e.f/multipole_expansion.f/pickpoints.f/print_t_values.f/read_h0.f/read_multipole_ints.f/reexpand.f/rotate_dipole.f/solvea.f/step1.f/step2.f/step3.f/step4.f/transmu.f/ttotal.f/warnings.f/wegotthis.f/yougetthis.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/mma_util
filetypes: ffffffffffffffffffff
filenames:
  allocate_iwork.f/allocate_work.f/c_null_alloc.c/cgetmem.c/cgetshmem.c/charMem.f/free_iwork.f/free_work.f/getmem.f/getshmem.f/idloc.c/iiloc.c/inimem.f/ip_of_iwork.f/ip_of_work.f/mama.fh/memman.f/setmem.f/stdalloc.f/stdalloc_mod.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/nq_util
filetypes: fffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  allok2_funi.f/angular_grid.f/angular_prune.f/aoadd_nq.f/box_on_sphere.f/calc_puvx2.f/comp_d.f/compute_d2mdx2.f/compute_d2odx2.f/compute_dmdx.f/compute_dodx.f/compute_grad.f/compute_m.f/compute_o.f/compute_rho.f/compute_t.f/compute_tau.f/convdfdrho.f/d2rho_dr2_lda.f/dede_funi.f/dft_grad.f/dft_int.f/dft_intx.f/do_batch.f/do_ggl.f/do_index.f/do_int_casdft2.f/do_lebedev.f/do_lebedev_sym.f/do_lobatto.f/do_nint.f/do_p2GLM.f/do_p2new.f/do_rhoia.f/drho_dr_gga.f/drho_dr_lda.f/drho_dr_meta_gga1.f/drho_dr_meta_gga2.f/drvnq.f/drvnq_inner.f/dwdr.f/eval_rmax.f/eval_rmin.f/free_dede_funi.f/funi_init.f/funi_input.f/funi_print.f/gauleg.f/genradquad_b.f/genradquad_mhl.f/genradquad_mk.f/genradquad_pam.f/genradquad_ta.f/genvoronoi.f/get_subblock.f/ggl_grid.f/grid_on_disk.fh/lebedev.f/lebedev_grid.f/lobatto.f/lobatto_grid.f/modify_nq_grid.f/nbas_eff.f/nq_Grid.f90/nq_init.f/nq_structure.fh/nqgrid_init.f/p2diff.f/phi_point.f/print_nq_info.f/process_coor.f/reset_nq_grid.f/resortd.f/rho_cas.f/rho_gga.f/rho_lda.f/rho_meta_gga1.f/rho_meta_gga2.f/rotgrd.f/setup_nq.f/soadpt_nq.f/sodist.f/subblock.f/w.f/w_partitioning.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/cpf
filetypes: fffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  ab.f/abcd.f/abci.f/ai_cpf.f/alloc_cpf.f/also.f/apprim.f/count.f/cpf.f/cpfctl.f/cpfmcpf.fh/cupdate.f/decomp.f/dens.f/densct.f/diag.f/diagc.f/diagct.f/diis.f/dsq2.f/epsbis.f/epsprim.f/faibj.f/fij.f/files_cpf.fh/fmul2.f/ifock.f/iijj.f/ijij.f/ijkl.f/indmat.f/ipo.f/ips.fh/jsunp.f/mab.f/mabcd.f/mabci.f/mai.f/main.f/mdiagc.f/mdsq2.f/mfaibj.f/mfij.f/mijkl.f/mpsq2.f/mtrans.f/natct.f/natorb.f/next.f/npset.f/onect.f/order.f/prwf.f/psq2.f/readin_cpf.f/restart.f/sdci_cpf.f/secord.f/setz.f/setzz.f/siadd.f/sing.f/solve.f/sort.f/sorta.f/sortb.f/spin_cpf.fh/squar.f/squar2.f/squarm.f/squarn.f/start_cpf.f/thetset.f/tpqset.f/tradd.f/twoct.f/vam.f/vecsum.f/vneg.f/vsadd.f/vsmsb.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/integral_util
filenames:
  Basis_Mode.fh/IOBuf.f/LundIO.f90/absadd.f/aces_gamma.f/aces_stuff.f/allok2.f/anal_gitt.f/angles.f/aoeval.f/appfld.f/auxil.f/banner.f/bino.f/binom.f/binte.f/carsph.f/change.f/chcar.f/chk_LblCnt.f/closep.f/clssew.f/cmbnac.f/cmbncb.f/cmbnmp.f/cmbnmpr.f/cmbnrf.f/cmpctr.f/cmpcts.f/cnthlf.f/cntrct.f/conmax.f/coset.f/covrad.f/covradt.f/covradt_init.f/crsph1.f/crsph2.f/crtcmp.f/dcr.f/dcr.fh/deaf.f/dede_scf.f/def_shells.f/dens_info.f/desym1.f/desymd.f/desymp.f/dgamma.f/doz.f/dozeta.f/drbuf.f/drv1_pcm.f/drv1_rf.f/drv2_rf.f/drv2el_scf.f/drvefp.f/drvk2.f/drvpcm.f/drvpcm_.f/drvrf.f/drvxv.f/dstncs.f/dwbuf.f/edip.f/eemax.f/efmmp.f/efnuc.f/efp_.f90/efp_module.f/efprm.f/efxf.f/ener.f/eperm.f/eq.f/esti.f/eval_ijkl.f/eval_ints_new.f/eval_ints_new_inner.f/exparr.f/expnd_i.f/fckacc.f/fckacc_nosym.f/fckdst.f/fiin.f/flip_flop.f/fradf.f/free_dede.f/free_herRW.f/free_isd.f/free_rctfld.f/freek2.f/gamma2.f/gamma_blocks.f/gammaf.f/gammat.f/gammln.f/gauss.f/gen_isd4.f/get_efp.f/get_info_dynamic.f/get_info_static.f/getinf.f/highfm.f/hmod.f/hrr.f/hrr1.f/hrrmtrx.f/ican.fh/icfrst.f/ichatm.f/ichxyz.f/iclast.f/icntrshl.f/ideg.f/iget.f/ijkl_inc.f/index_arrays.f/indsft.f/indsft2.f/inew.f/inisew.f/inisewm.f/init_pcm.f/init_rctfld.f/inputil.f/int_setup.f/integral_interfaces.f/integral_wrout.f/integral_wrout2.f/inter.f/inter1.f/ipntso.f/iprmt.f/irbuf.f/irrfnc.f/isd_data.f/iwbuf.f/k2_arrays.f/k2_setup.f/k2_structure.f/k2loop.f/kneprm.f/langevin.f/langevin_arrays.f/lattcr.f/lattxpol.f/lempty.f/lhr.f/lw_Info.f90/make_labels.f/memso1.f/memso2.f/memso2_P.f/memtra.f/mhrr.f/mk_dede.f/mk_so2ci.f/mk_triind.f/mltlbl.f/mltnuc.f/mltprm.f/modgauss.f/molcas_electron_density_field_fn.f/mp2alaska.fh/mpmc.f/n2tri.f/naprm.f/nbfshl.f/newpk.f/no_routine.f/nr_shells.f/nropr.f/nucexp.f/ochrr.f/oneel.f/oneel_ij.f/oneel_inner.f/oneel_integrals.f/oneel_property.f/ordexpd2c.f/pckint.f/pcmint.f/pgamma.f/pget0.f/pget1.f/pget1_aces.f/pget2.f/pget2_aces.f/pget3.f/pget4.f/phase.f/picky.f/picky_.f/plf.f/plf2.f/plf_fock.f/poti.f/prepp.f/priwel.f/prmtrx.f/prrf.f/psoao0.f/ptrans.f/ptrans_sa.f/qlm.f/qrint.f/radlc.f/radlq.f/rctfld.f/read_bin.f/read_blocks.f/real_spherical.f/rfint.f/rfmem.f/rfmltp.f/rfnuc.f/rint.f/rkappa_zeta.f/rlsmem_ints.f/rowel.f/rrint.f/schint.f/screen.f/set_basis_mode.f/set_basis_mode_atomic.f/set_binom.f/set_canind.f/setmltplcenters.f/setup1.f/setup_ints.f/setup_isd.f/setupa.f/seward_init.f/shell_copy.f/shell_mxdens.f/shell_mxschwz.f/size_sob.f/soadd.f/sofsh1.f/sogthr.f/soout.f/sos.f/sosctt.f/sp_mlt.f/sphcar.f/sphcr1.f/sphcr2.f/statp.f/stblz.f/stblzr.f/swap_seward.f/symad1.f/symadd2.f/symado.f/symadp.f/tcrtnc.f/term_ints.f/tetin.f/tnsctl.f/tranca.f/trapab.f/traxyz.f/trgrd_alaska.f/trgrd_alaska_.f/trns1.f/trns2.f/trnsps_seward.f/tstfnc.f/ttmul.f/twoel_new.f/unnrmlz.f/unnrmlz2.f/vassmbl.f/vcrtcmp.f/vrfmtrx.f/welcom.fh/wlbuf.f/wrcheck.f/xfmoment.f/xrlsmem_ints.f/xsetmem_ints.f/ylmnor.f/zxia.f

filetypes:
  ffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/intsort_util
filetypes: ffffffffffffff
filenames:
  mkord.F90/mksrt0.F90/mksrt1.F90/mksrt2.F90/savebin.F90/sort0.F90/sort1a.F90/sort1b.F90/sort1c.F90/sort2.F90/sort2a.F90/sort2b.F90/sort3.F90/sort_data.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/s390x-redhat-linux-gnu/CMakeFiles
filetypes: ddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddd
filenames:
  alaska/alaska_util/amfi_util/aniso_util/averd/caspt2/casvb/casvb_util/ccsd_util/ccsdt/ccsort_util/cct3_util/chcc/cholesky_util/cht3/cpf/dft_util/dkh_old_util/dkh_util/dynamix/espf/espf_util/expbas/extf/faiemp_util/false/ffpt/fmm_util/fock_util/ga_util/gateway/gateway_util/genano/grid_it/guessorb/guga/gugaci/gugadrt/input_util/integral_util/intsort_util/io_util/kriging_util/last_energy/ldf_fock_util/ldf_ri_util/linalg_util/localisation/localisation_util/loprop/loprop_util/lucia_util/mbpt2/mckinley/mclr/mcpdft/misc_util/mma_util/molcas_ci_util/motra/mpprop/mrci/mula/nq_util/numerical_gradient/oneint_util/parnell/pcm_util/peekpoke_util/poly_aniso/ppint_util/property_util/qmstat/quadpack_util/quater/rasscf/rassi/restart_util/ri_util/rpa/runfile_util/rys_util/scf/seward/single_aniso/slapaf/slapaf_util/surfacehop/system_util/transform_util/vibrot/wfn_util/xml_util


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/fock_util
filetypes: fffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  cho_FMO_red.f/cho_LK_casscf.f/cho_LK_mclr.f/cho_LK_rassi.f/cho_LK_rassi_x.f/cho_LK_scf.f/cho_cas_drv.f/cho_caspt2_openf.f/cho_eval_waxy.f/cho_fmcscf.f/cho_fock_dft_red.f/cho_fock_rassi.f/cho_fock_rassi_x.f/cho_focktwo.f/cho_focktwo_red.f/cho_fscf.f/cho_ftwo_MO.f/cho_get_mo.f/cho_geth1.f/cho_getshfull.f/cho_lk_settings.f/cho_lr_mos.f/cho_rassi_twxy.f/cho_sum.f/cho_x_quit.f/choras_drv.f/choscf_mem.f/coul_dmb.f/findmax.f/fmmfck.f/focktwo.f/focktwo_drv.f/fold.f/fold_mat.f/fold_tmat.f/ftwo.f/ftwo_drv.f/get_tuvx.f/mk_iShp_rs.F90/order_arrays.f/rdchovec.f/set_nna.f/set_nnbsf.f/swap_rs2full.f/swap_tosqrt.f/thouless_T1.f/tra2a.f/tra2b.f/tra2c.f/tra_ctl2.f/tractl2.f/tractl_drv.f/tradrv.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/ldf_ri_util
filenames:
  drv2el_localdf.f/int_ldf_2indx_11.f/int_ldf_2indx_12.f/int_ldf_3indx_1.f/int_ldf_gmax_s.f/int_ldf_jk_2p.f/int_ldf_sq.f/int_ldf_uvj.f/integral_wrout_ldf_diag.f/integral_wrout_ldf_g.f/ldf_a2ap.f/ldf_add2centerfunctions.f/ldf_addchargeconstraintcorrection.f/ldf_addconstraint.f/ldf_addconstraintcorrection.f/ldf_allocateauxbasvector.f/ldf_allocateblockmatrix.f/ldf_allocateblockvector.f/ldf_apd2indexintegrals.f/ldf_apd3indexintegrals.f/ldf_atom_info.fh/ldf_atomiclabels.f/ldf_atomiclabels.fh/ldf_blocked2full.f/ldf_charge.f/ldf_charge_constraint_info.fh/ldf_checkalloverlapintegrals.f/ldf_checkb2f.f/ldf_checkc_wld.f/ldf_checkcharge.f/ldf_checkintegrals.f/ldf_checkintegrals_jk_2p.f/ldf_checkpairintegrals.f/ldf_checkpsd_full.f/ldf_cho_setlupri.f/ldf_cio.fh/ldf_cio_final.f/ldf_cio_init.f/ldf_cio_readc.f/ldf_cio_readc_withlindep.f/ldf_cio_setunit.f/ldf_cleandiagonal.f/ldf_cleansheet.f/ldf_closec.f/ldf_comparefullandblocked.f/ldf_compute2indexintegrals.f/ldf_compute3indexintegrals.f/ldf_computeapproximateintegrals.f/ldf_computeauxint.f/ldf_computec.f/ldf_computecbar.f/ldf_computefittingcoefficients.f/ldf_computegmat.f/ldf_computeintegrals_jk_2p.f/ldf_computeintegrals_uvj.f/ldf_computeintegrals_uvj_2p.f/ldf_computeoverlapblock.f/ldf_computevalenceintegrals.f/ldf_computevalenceintegralsfromc.f/ldf_computezvec.f/ldf_constraintinfoisset.f/ldf_copyuniqueatompairs.f/ldf_dbguvj.f/ldf_final.f/ldf_findsignificantatompairs.f/ldf_fittedcharge.f/ldf_full2blocked.f/ldf_getatompairtouniqueatompairmap.f/ldf_getatomtouniqueatommap.f/ldf_getblockedoverlapmatrix.f/ldf_getcutint.f/ldf_getintegralsselectedbypsd.f/ldf_getthrs.f/ldf_info.f/ldf_init.f/ldf_integralerrorstat.f/ldf_integralprescreeninginfoisset.f/ldf_interactionrange.f/ldf_islindep.f/ldf_lt2q.f/ldf_map2cf.f/ldf_notimplemented.f/ldf_oneel.fh/ldf_openc.f/ldf_p_addauxbasvector.f/ldf_p_addblockmatrix.f/ldf_p_addblockvector.f/ldf_printatominfo.f/ldf_printatompairdiagonal.f/ldf_printatompairinfo.f/ldf_printauxbasinfo.f/ldf_printauxbasvector.f/ldf_printblockmatrix.f/ldf_printblockvector.f/ldf_printintegralprescreeninginfo.f/ldf_q2lt.f/ldf_qdiag.fh/ldf_quadraticdiagonals.f/ldf_quit.f/ldf_readatompairinfo.f/ldf_readunconstrainedcoefficients.f/ldf_removelindep.f/ldf_replicatedata.f/ldf_reset2cf.f/ldf_residualcd.f/ldf_restorediagonal.f/ldf_scaleblockmatrix.f/ldf_scaleoffdiagonalblocks.f/ldf_set2cl.f/ldf_setatominfo.f/ldf_setatompairinfo.f/ldf_setchargeconstraint.f/ldf_setconstraint.f/ldf_setdefaultthrs.f/ldf_setinc.f/ldf_setindx_jk_2p.f/ldf_setindxg.f/ldf_setintegralprescreeninginfo.f/ldf_setldf2.f/ldf_setmltplcenters.f/ldf_setoneel.f/ldf_setprescreen.f/ldf_setsh.f/ldf_setstatusonrunfile.f/ldf_setthrs.f/ldf_sortcanonical.f/ldf_sortcoefficients.f/ldf_testblockmatrix.f/ldf_unsetatominfo.f/ldf_unsetatompairinfo.f/ldf_unsetsh.f/ldf_updatediagonalfromc.f/ldf_updatediagonals.f/ldf_uvoffset.f/ldf_verifyfit.f/ldf_writeatompairinfo.f/ldf_writec.f/ldf_x_final.f/ldf_x_init.f/ldf_x_isset.f/ldf_x_opencoefficientfile.f/ldf_zeroauxbasvector.f/ldf_zeroblockmatrix.f/ldf_zeroblockvector.f/localdf_int.fh/localdf_int2.fh/localdf_int3.fh/localdf_print.fh/plf_ldf_2indx_11.f/plf_ldf_2indx_12.f/plf_ldf_3.f/plf_ldf_3indx_1.f/plf_ldf_diag.f/plf_ldf_g_1.f/plf_ldf_g_2.f/plf_ldf_g_3.f/plf_ldf_gmax_s.f/plf_ldf_jk_2p_1.f/plf_ldf_jk_2p_2.f/plf_ldf_jk_2p_3.f/plf_ldf_jk_2p_4.f/plf_ldf_sq.f/plf_ldf_uvj_1.f/plf_ldf_uvj_2.f/post_2center_ldf.f

filetypes:
  fffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/quadpack_util
filetypes: fffffffffffffff
filenames:
  d1mach.F90/dqag.F90/dqage.F90/dqagi.F90/dqagie.F90/dqelg.F90/dqk15.F90/dqk15i.F90/dqk21.F90/dqk31.F90/dqk41.F90/dqk51.F90/dqk61.F90/dqpsrt.F90/xerror.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/io_util
filetypes: ffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  aixcheck.F90/aixcls.F90/aixerr.c/aixfsz.F90/aixmv.F90/aixopn.F90/aixprd.F90/aixpwr.F90/aixrd.F90/aixrm.F90/aixwr.F90/allocdisk.c/append_file.F90/append_file_u.F90/bdafile.F90/cdafile.F90/chdafile.F90/cio.c/daclos.F90/daeras.F90/dafile.F90/dafile_checkarg.F90/daname.F90/daname_main.F90/daname_mf.F90/daname_mf_wa.F90/daname_wa.F90/ddafile.F90/f_inquire.F90/fast_io.F90/fastio.F90/fcopy.F90/filesystem_wrapper.c/find_lu.F90/fioinit.F90/fscb2unit.F90/get_mbl_wa.F90/handle2name.F90/idafile.F90/is_opened.F90/isfreeunit.F90/lu2desc.F90/lu2handle.F90/molcas_binaryopen_vanilla.F90/molcas_open.F90/molcas_open_ext.F90/mpdafile.F90/next_non_comment.F90/prgm.F90/prgminit.F90/prgmtranslate.F90/prgmtranslate_master.F90/prgmtranslatec.F90/zip.c


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/rasscf
filenames:
  CC_CI.f90/CI_solver_util.f/alloc.f/alter_mo.f/casdft_terms.f/casinfo1_rvb.f/check_invec.f/chkifkey.f/chkinp.f/cho_rasscf_rdinp.f/cictl.f/cisx.f/clnmo.f/clsfls_rasscf.f/cmsrot.f/covlp.f/cpinp.f/cre_raswfn.f/creiph.f/cvbinp_rvb.f/cvbmn_rvb.f/cvbstart_rvb_lt9.f/davcre.f/dblock.f/dmatdmat.f/dmrgctl.f/drt.f/drt0.f/export1.f/expx.f/fcidump.f90/fcidump_dump.f90/fcidump_reorder.f90/fcidump_tables.f90/fcidump_transformations.f90/fciqmc.f/fciqmc_make_inp.f/fciqmc_read_RDM.f/fckpt2.f/fmat.f/fock.f/fockoc.f/gas_data.f/gasprwf.f/general_data.f/generic_CI.f90/get_d1a.f/get_d1i.f/guess.f/gugactl.f/gugx_data.f/hmat.f/index_symmetry.f/inppri.f/input_ras.fh/ivogen_rasscf.f/linpur.f/main.f/make_close_rvb.f/mkcot.f/mkcrvec.f/mkdaw.f/mkguga.f/mkmid.f/mknsm.f/mkproj.f/mkraw.f/mksgnum.f/mod_p2.f/natorb_rasscf.f/neworb_rasscf.f/opnfls_rasscf.f/ortho.f/ortho1.f/ortho2.f/orthonormalization.f/orthonormalize.fh/outctl.f/outctlSplit.f/ovlp.f/pmat_rasscf.f/prdrt.f/primo_rasscf.f/printRDMs_NECI_format.f/print_mcpdft.f/proc_inp.f/prttim.f/putrlx.f/qcmaquis_rdinp.f/qnctl.fh/qune.f/rasscf.f/rasscf_init.f/rasscf_mcontrol.f/raswfn.fh/rd1int.f/rd2int_rasscf.f/rdsups.f/readin_vb.f/readvc.f/restr.f/rotorb.f/rotstate.f/scan_inp.f/setpos.f/setprlev.f/setsxci.f/sgfcin.f/sgprwf.f/sigvec.f/socc_dmrg_rdinp.f/sphpur.f/spinorb.f/supsch.f/sxci.fh/sxctl.f/sxham.f/ug2sg.f/upd_fa.f/write_orbital_files.f/xmsrot.f

filetypes:
  fffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/misc_util
filenames:
  MckDat.fh/OA.f90/OneDat.fh/RdOrd.fh/blas_wrappers.f90/breakpoint.f/c2r8.f/ceil.c/cg_solver.f/check_parallel_data.f/chk4nan.f/clsmck.f/clsone.f/clsord.f/cmpint.f/crdmck.f/crecprt.f/cwrmck.f/dblfac.f/decideon1ccd.f/decideondf.f/decideondirect.f/decideonespf.f/decideonlocaldf.f/dgemm_tri.f/diag_driver.f/disable_spool.f/dmpone.f/done_rasscf.f/drdmck.f/dsq.f/dvcprt.f/dwrmck.f/dzero.f/efp_on.f/errtra.f/expand_coor.f/fix_symmetry.f/fmmm.f/full_svd.f/genint.f/get_int.f/get_progname.f/getord.f/getseed.f/gf_print.f/givens.f/gs.f/hasnonnegativediagonal.f/i4len.f/icopy.f/icunp.f/inipkr8.f/init_getint.f/initim.f/int2real.f/is_first_iter.f/isconstant.f/issymmetric.f/iswap.f/ivcprt.f/iwrmck.f/iwrtma.f/jacob.f/jacord.f/jacscf.f/langevin_on.f/lapack_wrappers.f90/large_svd.f/lcopy.f/leftad.f/lineqsolv.f/loadints.f/log2int.f/minv.f/molpro_chtab.f/mxmt.f/nrmclc.f/ntoken.f/obeyscauchyschwarz.f/one_ulp.c/onebas.f/opnfl.f/opnmck.f/opnone.f/opnord.f/ordin1.f/ordin2.f/pcm_on.f/pki4.f/pkr8.f/potnuc_nad.f/prcoor.f/print_eigenvalues.f/printtim.f/qldiag.f/r8len.f/r8prep.f/random.f/random_vector.f/rdmck.f/rdnlst.f/rdone.f/rdord.f/rdord_.f/recprt.f/reduce_prt.f/relene.f/rf_on.f/rightad.f/rld_r8.c/rle_r8.c/rmass.f/savtim.f/small_svd.f/sortdiag.f90/sorteig.F90/sorting.F90/sorting_funcs.F90/sp_ICD.f/sp_MV.f/sp_pack.f/sp_symmetrize.f/sp_transpose.f/sp_trisolve.f/sp_unpack.f/spoolinp.f/sqprt.f/square.f/stdfmt.f/strnln.f/strtochk.f/subrecprt.f/subtrcprt.f/superpose.f/tc_getfullcoords.f/tc_rot.f/tc_thermochem.f/tcd_r8.c/tce_r8.c/tcl_r8.c/thermo_driver.f/tmltpl.f/trcprt.f/triexp.f/triprt.f/trnsps.f/unused.f/upki4.f/upkr8.f/vdiv.f/veig.f/vmov.f/vsma.f/vsmul.f/wr_guga_info.f/wr_motra_info.f/wr_rasscf_info.f/wrh.f/wrmck.f/wrone.f/wrtlbl.f/wrtmat.f/xspot.f

filetypes:
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dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/slapaf
filetypes: fffffffffffffffffffffffffffffffffffff
filenames:
  c1diis.f/c2diis.f/chkpnt.f/con_opt.f/convrg.f/dfp.f/drvuph.f/dstinf.f/eu.f/find_distance.f/fixhess.f/free_updmask.f/g_nrm.f/init_updmask.f/main.f/mep_dir.f/msp.f/mxlbls.f/newcar_kriging.f/newh.f/newh_mod.f90/newq.f/outzmat.f/qnr.f/reset_thrgrd.f/rlxctl.f/rs-i-rfo.f/rs-p-rfo.f/rs-rfo.f/slapaf.f/slapaf_banner.f90/status.f/ts_bfgs.f/update_H.f/update_inner.f/update_kriging.f/update_sl.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/vibrot
filetypes: fffffffffffffff
filenames:
  dminv.F90/main.F90/pot.F90/prwf.F90/simpsn.F90/sort_pot.F90/spectc.F90/spline.F90/vibinp.F90/vibmat.F90/vibrot.F90/vibrot_globals.F90/vibrotmain.F90/vibtrm.F90/wr_vibrot_info1.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/dft_util
filenames:
  KSDFT_Info.f90/KT.f/b2plyp.f/b3lyp.f/b3lyp5.f/b86lyp.f/b86pbe.f/blyp.f/blyp_emb.f/blyp_emb2.f/bpbe.f/bwig.f/cblyp_emb.f/check_Fthaw.f/checker.f/cm06.f/cpbe.f/cpbe_emb.f/cpbe_ofe.f/cpbesol.f/cspbe.f/ctca.f/cvs98.f/cwig.f/diracx.f/diracx_ofe.f/do_cs.f/do_newfunctional.f/do_newfunctional_1.f/drvdft.f/drvemb.f/func_emb.f/get_exfac.f/glyp.f/gpbe.f/hfb.f/hfb86.f/hfg.f/hfo.f/hfs.f/kt2.f/kt3.f/lsda.f/lsda5.f/lsda5_emb.f/lsda_emb.f/lyp.f/lyp_ofe.f/lyppi.f/m06.f/m062x.f/m06L.f/m06hf.f/ndsd_ts.f/newf.f/newf1.f/nlyp.f/nucatt.f/nucatt_emb.f/o2plyp.f/o3lyp.f/ofe_print.f/ofembed.f90/olyp.f/opbe.f/overlap.f/pbe.f/pbe0.f/pbe_emb.f/pbe_emb2.f/pbesol.f/points.fh/ptca.f/pw92c.f/revpbe.f/rge2.f/s12g.f/s12h.f/ssbd.f/ssbsw.f/tf_ts.f/tlyp.f/ts_only_emb.f/vW_hunter.f/vW_ts.f/vwn_III.f/vwn_III_emb.f/vwn_V.f/vwn_V_emb.f/xB86.f/xB88.f/xB88_ofe.f/xG96.f/xOPT.f/xS12gh.f/xalpha.f/xhole.f/xm06.f/xpbe.f/xpbe_ofe.f/xpbesol.f/xrevpbe.f/xrge2.f/xssbd.f/xssbsw.f/xvs98.f

filetypes:
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dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/ri_util
filetypes: fffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  a_3c_qv_s.f/bdshell.fh/cd_ainv.f/cho_factor.f/cho_get_grad.f/cho_reorder_ri.f/cho_ri_putinfo.f/cho_ri_swapvecunit.f/chunk_mod.F90/compute_a_jk.f/compute_auxvec.f/compute_b.f/compute_txy.f/compute_v12.f/contract_zpk_tpxy.f/create_chunk.f/decideoncholesky.f/destroy_chunk.f/drv2el_2center_ri.f/drv2el_3center_ri.f/drv2el_atomic_nosym.f/drv2el_ri_diag.f/drvg1_2center_ri.f/drvg1_3center_ri.f/drvg1_ri.f/effective_CD_pairs.f/exterm.F90/fix_coeff.f/fix_exponents.f/gen_qvec.f/get_MaxDG.f/get_chunk.f/get_mXOs.f/get_pivot_idx.f/get_pivot_idx_w.f/indsft_RI_2.f/indsft_RI_3.f/inicho_ri.f/integral_RI_2.f/integral_RI_3.f/integral_ricd.f/inv_cho_factor.f/iramax.f/j12.F90/mk_acd_accd_shells.f/mk_coeffs.f/mk_dummy_shell.f/mk_indkl.f/mk_iso2ind.f/mk_list2.f/mk_naccd.f/mk_ri_shells.f/mk_ricd_shells.f/mk_tint_p.f/mk_tvt.f/mk_tvtf.f/mn2k.f/modify_tint_p.f/mult_3c_qv_s.f/mult_rijk_qkl.f/mult_vk_qv_s.f/mult_with_q_mp2.f/mult_zp_qv_s.f/nmemam.f/nsize_3c.f/nsize_rv.f/o2n.f/pget1_cd2.f/pget1_cd3.f/pget1_ri2.f/pget1_ri3.f/pget2_cd2.f/pget2_cd3.f/pget2_ri2.f/pget2_ri3.f/pget2_ri3.fh/pivot_mat.f/plf_ri_2.f/plf_ri_3.f/plf_ricd.f/post_2center_ri.f/put_chunk.f/remap_u_k.f/remap_v_k.f/renorm2.f/reord_vk.f/restore_mat.f/ri_xdiag.f/ricd_helper.f/rm_auxshell.f/set_cho_adrvec.f/setup_aux.f/sort_mat.f/square_a.f/termcho_ri.f/tsk2.F90/tskman2.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/rys_util
filetypes: ffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  abtab.fh/ass1.f/ass1a.f/ass1b.f/ass2.f/ass2a.f/ass2b.f/ass3.f/ass3a.f/ass3b.f/assg1.f/assg1_mck.f/assg2.f/cff2d.f/cff2dq.f/cff2ds.f/closer.f/distg1.f/distg1x.f/distg2.f/drvrys.f/exp_1.f/exp_2.f/fake.f/her_rw.f/hrr2da.f/hrr2da_mck.f/hrr2db.f/hrr2db_mck.f/hrrctl.f/hrrctl_mck.f/leg_rw.f/memrg1.f/memrg2.f/memrys.f/memrys_g.f/modu2.f/pppp.f/ppps.f/ppss.f/pr2d.f/psps.f/psss.f/read_abdata.f/read_rysrw.f/rs2dgh.f/rs2dmm.f/rtswgh.f/rys.f/rys01.f/rys11.f/rys22.f/rys2d.f/rys2dg.f/rys33.f/rys44.f/rys55.f/rys66.f/rys77.f/rys88.f/rys99.f/rysef.f/rysef0.f/rysef1.f/rysef2.f/rysef3.f/rysef4.f/rysg1.f/rysg2.f/rysrtswgh.f/sether.f/setup_rw.f/setupr.f/sppp.f/spsp.f/sspp.f/sssp.f/ssss.f/teri.f/teri1.f/teris.f/terisq.f/tnai.f/tnai1.f/vcff2d.f/vrys2d.f/vrys2dm.f/vrys_rw.f/vrysrw.f/wrj12.f/xcff2d.f/xrys2d.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/loprop
filetypes: fffffffffff
filenames:
  build_amatrix.F90/comp_f.F90/dynamic_properties.F90/fluctuating.F90/main.F90/make_fluctuating_charges.F90/move_polar.F90/polar.F90/print_local.F90/print_mpprop.F90/readin_polar.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/mcpdft
filetypes: ffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  alloc.f/alter_mo.f/check_invec.f/chkifkey.f/chkinp.f/cho_rasscf_rdinp.f/clnmo.f/clsfls_rasscf.f/cpinp.f/creiph.f/cvbinp_rvb.f/dblock.f/dmatdmat.f/drt.f/drt0.f/fmat.f/fock.f/fockoc.f/get_d1a.f/get_d1i.f/guess.f/gugactl.f/inppri.f/input_ras_mcpdft.fh/linpur.f/main.f/make_close_rvb.f/mcpdft.f/mkclist.f/mkcot.f/mkdaw.f/mkguga.f/mkmid.f/mknsm.f/mkraw.f/mksgnum.f/msctl.f/mspdft.fh/oncmo.f/opnfls_rasscf.f/orbfiles.f/orthonormalize_mcpdft.fh/ovlp.f/pmat_rasscf.f/prdrt.f/primo_rasscf.f/print_mcpdft.f/proc_inpX.f/prttim.f/qnctl_mcpdft.fh/rasscf_init.f/rd1int.f/rd2int_rasscf.f/rdsups.f/readin_vb.f/readvc.f/restr.f/scan_inp.f/setpos.f/setprlev.f/setsxci.f/sgfcin.f/sgprwf.f/sigvec.f/sphpur.f/sxci_mcpdft.fh/ug2sg.f/upd_fa.f/wjob.fh/writejob.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/oneint_util
filetypes: ffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  PAM2.f90/ampint.f/ampmem.f/ampr.f/ass_px.f/ass_pxp.f/assemble_dTdmu.f/assemble_dVdB.f/assemble_mgauss.f/assmbl.f/cassmbl.f/ccmbnmp.f/ccmbnve.f/ccrtcmp.f/cmbnke.f/cmbnke_giao.f/cmbnker.f/cmbnmp_giao.f/cmbnmv.f/cmbnve.f/cntint.f/cntmem.f/contact.f/cvelint.f/d1int.f/d1mem.f/dTdmu_int.f/dTdmu_mem.f/darwin.f/dmsint.f/dmsmem.f/efint.f/efmem.f/emfint.f/emfmem.f/epeint.f/epemem.f/kneint.f/kneint_giao.f/knemem.f/knemem_giao.f/knemmp.f/kntc.f/kntc_giao.f/m1int.f/m1mem.f/m2int.f/m2mem.f/mltint.f/mltint_giao.f/mltmem.f/mltmem_giao.f/mltmmp.f/mve.f/mveint.f/mvemem.f/naint.f/naint_giao.f/namem.f/namem_giao.f/oamint.f/oammem.f/omqint.f/omqmem.f/one2h5.f/p_int.f/p_mem.f/pam2int.f/potint.f/prjint.f/prjmem.f/pvint.f/pvmem.f/pxint.f/pxmem.f/pxpint.f/pxpmem.f/qpvint.f/qpvmem.f/sroint.f/sromem.f/util1.f/util2.f/util3.f/util4.f/util5.f/util8.f/veint.f/velint.f/vemem.f/vpint.f/vpmem.f/welint.f/welmem.f/xfdint.f/xfdmem.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src
filetypes: dddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddddd
filenames:
  Include/alaska/alaska_util/amfi_util/aniso_util/averd/caspt2/casvb/casvb_util/ccsd_util/ccsdt/ccsort_util/cct3_util/chcc/cholesky_util/cht3/cpf/dft_util/dkh_old_util/dkh_util/dynamix/espf/espf_util/expbas/extf/faiemp_util/false/ffpt/fmm_util/fock_util/ga_util/gateway/gateway_util/genano/grid_it/guessorb/guga/gugaci/gugadrt/input_util/integral_util/intsort_util/io_util/kriging_util/last_energy/ldf_fock_util/ldf_ri_util/linalg_util/localisation/localisation_util/loprop/loprop_util/lucia_util/mbpt2/mckinley/mclr/mcpdft/misc_util/mma_util/molcas_ci_util/motra/mpprop/mrci/mula/nq_util/numerical_gradient/oneint_util/parnell/pcm_util/peekpoke_util/poly_aniso/ppint_util/property_util/qmstat/quadpack_util/quater/rasscf/rassi/restart_util/ri_util/rpa/runfile_util/rys_util/scf/seward/single_aniso/slapaf/slapaf_util/surfacehop/system_util/transform_util/vibrot/wfn_util/xml_util


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/slapaf_util
filenames:
  align.f/angle_list.f/arcos.f/arsin.f/atmlst.f/backup_info.fh/bend.f/bmtrx.f/bmtrx_cartesian.f/bmtrx_internal.f/bmtrx_user_defined.f/bond_list.f/bond_tester.f/bondtypes.fh/box.f/bput.f/branching_plane_update.f/chklbl.f/ci_summary.f/cllct.f/cllct2.f/cllctof.f/conint.f/connect_fragments.f/cosys.f/cp_spcint.f/d_bend.f/d_bond.f/d_cart.f/d_trsn.f/davidson.f/dbutil.f/ddv.f/ddvdt.fh/ddvdt_RF.fh/ddvdt_bend.fh/ddvdt_bond.fh/ddvdt_outofp.fh/ddvdt_trsn.fh/def_ctof.f/defint.f/defint2.f/diagmtrx.f/dihedr.f/dissoc.f/elred.f/eq_solver.f/find_bonds.f/find_min.f/find_rfo_root.f/fix_udc.f/fixic.f/force.f/formnumhess.f/freq1.f/fupdt.f/gencoo.f/get_curvil.f/get_ddipm.f/get_h.f/get_molecule.f/gf.f/gf_harmonic_frequencies.f/gf_mult.f/gf_on_the_fly.f/hess_tra.f/hess_vec.f/hidden.f/hrmfrq.f/hss_q.f/init2.f/init_slapaf.f/intergeo.f/intfcm.f/itabrow.f/iu.f/iur.f/lbend.f/list.f/list2.f/lnm.f/lnsrch.f/magic_bonds.f/merge_constraints.f/mk_g.f/mk_hss_q.f/nacint.f/ncobond.f/newcar.f/nmhess.f/nonsym.f/nred.f/nu.f/nwshft.f/nxtwrd.f/oldfcm.f/optrms_slapaf.f/outcoor.f/outofp.f/outofplane_list.f/prb.f/prepro.f/preprocess_UDC.f/print_mode_components.f/printq.f/prlist.f/process_gradients.f/process_track.f/projsym.f/projsym2.f/r_stab_a.f/rd_udic.f/rdctl_slapaf.f/reacq.f/reacx.f/remove_TR.f/rf_coord.f/rotder.f/rowhessian.f/select_hidden.f/set_l_array.f/setup_kriging.f/shfanm.f/slapaf_info.f90/slapaf_parameters.f90/sort_to_box.f/sphint.f/start_alaska.f/start_last_energy.f/strtch.f/supsym.f/symdsp.f/thermochem.f90/thrdo.f/torsion_list.f/transverse.f/trmake.f/trpgen.f/trsn.f/union.f/valanm.f/wrinp_sl.f/write_qmmm.f

filetypes:
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dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/espf_util
filetypes: ffffffffffffffffffffffffffffffff
filenames:
  bdvgrd.f/calcdt.f/drv1_pot.f/drvespf.f/drvpot.f/espf.f/espf.fh/espf_analysis.f/espf_energy.f/espf_grad.f/espf_init.f/espf_mltp.f/espf_write.f/extnuc.f/gmx_wrapper.c/h1_espf.f/initb.f/initdb.f/ipl_espf.f/la_morok.f/mkgrid.f/mmcount.f/no_espf.f/opt_mmo.f/opt_mmo.fh/pcm_cavity.f/pnt.f/prepare.f/readin_espf.f/rungromacs.f/runtinker.f/selfen.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/scf
filenames:
  addcorr.fh/aufbau.f/c_adjust.f/chklumo.f/chkort.f/chktrd.f/cho_scf_rdinp.f/choauf.fh/choscf_drv.f/clsbuf.f/clsfls_scf.f/cre_scfwfn.f/davidson_scf.f/dcore.f/dcscf.fh/densab.f/dfroz.f/dgrd.f/diis_i.f/diis_x.f/dmat.f/done_scf.f/dumpcmo.f/dumpeor.f/egrad.f/eneclc.f/errv.f/expkap.f/fao2fmo.f/file.fh/final.f/fixorb.f/focktwo_drv_scf.f/focktwo_scf.f/freeze.f/get_DEcorr.f/get_Enondyn_dft.f/getgap.f/gmfree.f/grdclc.f/infscf.fh/infso.fh/inibuf.f/inisew_scf.f/init_scf.f/interfaces_scf.f90/iprlv.fh/ivogen.f/ldfscf.fh/ldfscf_drv.f/llists.fh/lnklst.f/lnklst.fh/main.f/memalo.f/mindns.f/mkeorb.f/modens.f/modfck.f/mulpop.f/natouhf.f/neworb_scf.f/occdef.f/occsets.f/opnfls_scf.f/optclc.f/optclc_nqr.f/optim.f/optim2.f/orb_type.f/ortho.f/orthox.f/ovldel.f/padcmo.f/padeor.f/pickup.f/pmat_scf.f/prbeg.f/prfin.f/prfin0.f/prfin2.f/prite.f/r1ibas.f/r1inta.f/r1intb.f/rd2int_scf.f/rdinp_scf.f/readin_scf.f/releny.f/rotmos.f/rs-rfo-scf.f/rwdtg.f/save.fh/scf.f/scf_arrays.f/scf_energy.f/scf_init.f/scf_mcontrol.f/scfwfn.fh/scram.f/setup.f/soinih.f/sorb.f/sorbchk.f/sort2cmos.f/sortcmos.f/sorupv.f/start0.f/start0x.f/start0y.f/start2.f/start3.f/start6.f/swiopt.f/traclc_i.f/traclc_x.f/trafck.f/trgen.f/trimcmo.f/trimeor.f/tw_corr_drv.f/updfck.f/vecfind.f/voo2ov.f/wfctl_scf.f/wrinp_scf.f/xxlowdin.f

filetypes:
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dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/amfi_util
filetypes: ffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  amfi.f/angular.f/buildcoul.f/cartonex.f/cartoney.f/cartonez.f/chngcont.f/cont.f/contandmult.f/contcasaOO.f/contcasaSO.f/contcasb1OO.f/contcasb1SO.f/contcasb2OO.f/contcasb2SO.f/contcascOO.f/contcascSO.f/contone.f/contract.f/couple3J.f/daxpint.f/dofuc.fh/drv_amfi.f/gen1overR3.f/gencoul.f/gencoulDIM.f/genovlp.f/genpowers.f/genprexyz.f/genprexyz10.f/genprexyz11.f/genprexyz12.f/genprexyz13.f/genprexyz14.f/genprexyz15a.f/genprexyz2.f/genprexyz3.f/genprexyz4.f/genprexyz5.f/genprexyz6.f/genprexyz7.f/genprexyz8.f/genprexyz9.f/genstar.f/gentkin.f/getAOs.f/getAOs2.f/getCG.f/getlimit.f/getpow.f/inidf.f/initfrac.f/initired.f/ipowxyz.fh/ired.fh/kindiag.f/kinemat.f/lmdepang.f/mcheckxy.f/mcheckz.f/mkangl0.f/mkanglmin.f/nucleus.fh/para.fh/param.fh/prefac.f/readbas.f/regge3j.f/symtrafo.f/tkinet.f/tosigx.f/tosigy.f/tosigz.f/trans_amfi.f/transcon.f/two2mean12a.f/two2mean12b.f/two2mean13.f/two2mean34a.f/two2mean34b.f


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/xml_util
filetypes: ffffffffffffffff
filenames:
  xml_cdump.F90/xml_cdumpa.c/xml_cdumpb.c/xml_cdumpc.c/xml_cdumps.c/xml_close.F90/xml_closec.c/xml_ddump.F90/xml_ddumpc.c/xml_idump.F90/xml_idumpc.c/xml_open.F90/xml_openc.c/xml_prspec.c/xml_sdump.F90/xmlapi.h


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/guessorb
filetypes: fffffffffffffff
filenames:
  cre_gsswfn.F90/fckbyint.F90/fmod1n.F90/fmod1s.F90/fockoper.F90/golowdin.F90/gopickup.F90/gopop.F90/gosort.F90/guessorb.F90/guessorb_global.F90/initgo.F90/inpctl_guessorb.F90/main.F90/virt_space.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/dkh_old_util
filenames:
  at34r.f/auxc.f/bssint.f/copy_dkoperators.f/copy_dkoperators_i.f/cp_prop_int.f/crelop.fh/dcopiv.f/der.f/determine_factor2.f/diag_dkh.f/distribution.f/dkh_char2int.f/dkh_driver.f/dkh_int2char.f/dkh_int2char2.f/dkhinf.f/dkhparameters.fh/dkhparser_numeric.f/dkhparser_symbolic.f/dkrelint.f/edirac.f/equalstring.f/evalstring.f/evalstring2.f/evaluate_sxxx.f/evaluate_txxx.f/evaluate_uxxx.f/even2.f/even3.f/exp_param.f/extc.f/fillma.f/finalize.f/finalize2.f/gam.f/get_dkhstring.f/get_dkoperators.f/get_dkoperators_i.f/get_maxelem.f/get_numbers.f/initialize1.f/initialize2.f/insert_ri.f/intrea.f/jacob_rel.f/ldkh.f/matinv.f/movebraces.f/multiply.f/multiply2.f/nprop_int.f/operators_u.f/ordertest.f/other_paparm.f/output1.f/output11.f/output12.f/output2.f/output2b.f/output3.f/output3b.f/output4.f/output5.f/output6.f/output7.f/output8.f/ovlmp.f/phi.f/piknam.f/prmat.f/prsq.f/put_dkoperators.f/put_dkoperators_i.f/rdname.f/red_dkhstring.f/relint.f/relop.f/relsew.f/relsewb.f/relsewc.f/removeb1.f/removeb2.f/replace1.f/replace2.f/replace3.f/replace_sxxx.f/repmat.f/s_create.f/setup_matrices.f/simplify1.f/simplify2.f/simplify3.f/simplm.f/sog.f/sort_op1.f/sort_op2.f/store_reschar.f/subs_dkhstring.f/substitute_term.f/t_create.f/theta.f/trsm_dkh.f/trsmt.f/trunc_dkh.f/u_create.f/u_operators.f/vpbmbpv.f/write_operators.f

filetypes:
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dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/ldf_fock_util
filetypes: fffffffffffffffffffffff
filenames:
  ldf_auxbasvectornorm.F90/ldf_blockmatrixnorm.F90/ldf_computecoulombintermediates.F90/ldf_computecoulombintermediates0.F90/ldf_computeu.F90/ldf_fci.F90/ldf_fock_coulomberror.F90/ldf_fock_coulomberroranalysis.F90/ldf_fock_coulombonly.F90/ldf_fock_coulombonly0.F90/ldf_fock_coulombonly0_.F90/ldf_fock_coulombonly0_1.F90/ldf_fock_coulombonly0_2.F90/ldf_fock_coulombonly0_3.F90/ldf_fock_coulombonly_.F90/ldf_fock_coulombonly_xidi.F90/ldf_fock_coulombupperbound.F90/ldf_fock_coulombupperbound_full.F90/ldf_fock_coulombupperboundnorm.F90/ldf_fock_coulombupperboundnorm_full.F90/ldf_fock_cub.F90/ldf_ftst.F90/ldf_fvifc.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/chcc
filenames:
  adh_hvv2.f/adt_t17.f/adv_a23.f/adv_g2.f/autosegmentation.f/calc_addg.f/calc_addsg.f/calc_bc.f/calcaddpp.f/chcc.f/chcc1.fh/chcc_casy.fh/chcc_files.fh/chcc_reord.fh/chck_0.f/chck_a.f/chck_aa.f/chck_b.f/chck_energ.f/chck_goo.f/chck_gvv.f/chck_h1.f/chck_hoo.f/chck_hvo.f/chck_hvv.f/chck_k.f/chck_l1.f/chck_l2.f/chck_mkj.f/chck_mkk.f/chck_q.f/chck_t1.f/chck_t17g.f/chck_t1g.f/chck_t21.f/chck_t21od.f/chck_t2n.f/chck_t2p.f/chck_t2sym.f/chck_th.f/chck_tjedna.f/chck_tx.f/chck_v.f/chck_vx.f/chck_w1.f/chck_w2p.f/chck_w3.f/chck_w31.f/chck_w4.f/chck_x.f/chck_xred.f/chck_y.f/checkmem.f/cho_cc_drv.f/cve2.f/defparo2v4.f/defparo3v3.f/defparo3v3hlp1.f/defparo3v3hlp2.f/defparreord.f/defw34y.f/defw3y.f/defw4abcd.f/defw4abdc.f/defw4bacd.f/defw4badc.f/defw4cdab.f/defw4cdba.f/defw4dcab.f/defw4dcba.f/defw4y.f/defw4y2.f/dfh_hvv1.f/distmemchck.f/distmemo2v4.f/distmemo3v3chol.f/distmemo3v3jk.f/distmemo3v3t2.f/distmemperm.f/distmemreord.f/distmemsum.f/energy_e1.f/energy_e2d.f/energy_e2od.f/exa_x4.f/exh_t13.f/exh_x2.f/exp1.f/exp2.f/exp2i.f/exp4.f/expt2.f/ext_aex.f/ext_l0.f/ext_l1.f/ext_l2s.f/ext_l2u.f/ext_w3.f/ext_w4.f/ext_w4hlp1.f/ext_w4hlp2.f/ext_w4hlp3.f/extractm.f/extt1.f/exv_x41.f/exv_x42.f/exv_x43.f/findnexteffseg.f/frankie.f/frankie_drv.f/frankie_drv_fake.f/getchckdata.f/getchv.f/getchvhlp1.f/getchvhlp2.f/getchvhlp3.f/getchvhlp4.f/getrest.f/gett2n.f/gettau.f/gettauhlp1.f/gettauhlp2.f/getx.f/inireord.f/insl.f/insreaw3.f/insreaw4.f/insreqo2v4.f/joinlvec.f/main.f/makechckdata.f/maket2m.f/maket2p.f/maket2pd.f/maket2pdhlp.f/maket2phlp1.f/maket2phlp2.f/maket2phlp3.f/maket2pthlp1.f/maket2pthlp2.f/maket2pthlp3.f/makeww.f/makewwd.f/makewwdhlp1.f/makewwdhlp2.f/makewwhlp1.f/makewwhlp2.f/makewwhlp3.f/makewwhlp4.f/map2_21.f/map3_132.f/map3_213.f/map3_321.f/map4_1243.f/map4_1324.f/map4_1342.f/map4_1423.f/map4_1432.f/map4_2143.f/map4_2314.f/map4_3124.f/map4_3142.f/map4_3214.f/map4_3412.f/map4_3421.f/map4_4123.f/map4_4312.f/mc0c2a3b.f/mk_t1t.f/mkd_q46.f/mke_y3.f/mki_q47.f/mkl0.f/mkl2_chcc.f/mknamev3.f/mknamev4.f/mkoe.f/mkq0.f/mkq1.f/mkq22.f/mkq3.f/mkq4.f/mkt1t2.f/mkt20p.f/mkt20u.f/mkt_c136od.f/mkt_c245od.f/mkt_c78d.f/mkt_c78od.f/mkt_calld.f/mkt_exp.f/mkt_qk42.f/mkt_red.f/mkt_t15.f/mkt_t17.f/mktau_chcc.f/mkv_a1.f/mkv_a4.f/mkv_goo3.f/mkv_hoo2.f/mkv_hvo2.f/mkv_hvv2.f/mkv_k22.f/mkv_q22.f/mkv_t18.f/mo_transp.f/mv0sv.f/mv0u.f/mv0v1u.f/o2v4.f/o2v4.fh/o2v4ctl.f/o3v3.fh/o3v3chol.f/o3v3ctl.f/o3v3jk.f/o3v3t2.f/parcc.fh/rea1.f/rea_chcc.f/read_mo.f/reaw.f/reaw3.f/reaw3hlp1.f/reaw3hlp2.f/reaw3hlp3.f/reaw4.f/reord_chcc.f/rnfill.f/savechckdata.f/saverest.f/savex.f/summary.f/t1_div.f/t2d_div.f/t2od_div.f/upg_t1.f/upg_t2d.f/upg_t2od.f/urobchv.f/urobi1.f/urobi2.f/urobi3.f/urobint.f/urobl1.f/urobl2.f/urobt2.f/urobtau.f/vanisht1.f/vanisht2n.f/wri_chcc.f/xo2v4ctl.f

filetypes:
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dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/kriging_util
filetypes: fffffffffffffffffffff
filenames:
  backtrans_k.F90/covarmatrix.F90/covarvector.F90/dispersion_kriging.F90/dispersion_kriging_layer.F90/energy_kriging.F90/energy_kriging_layer.F90/finishing_kriging.F90/gradient_kriging.F90/gradient_kriging_layer.F90/hessian_kriging.F90/hessian_kriging_layer.F90/kriging_mod.F90/kriging_model.F90/matderiv.F90/matern.F90/pgek.F90/predict.F90/set_l_kriging.F90/start_kriging.F90/trans_k.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/cct3_util
filenames:
  cct3.f/cct3_add.f/cct3_add10.f/cct3_add21.f/cct3_add22.f/cct3_add32.f/cct3_add41.f/cct3_add42.f/cct3_add43.f/cct3_add44.f/cct3_divfok.f/cct3_expand.f/cct3_expand0.f/cct3_expand1.f/cct3_expand2.f/cct3_expand3.f/cct3_expand40.f/cct3_expand41.f/cct3_fokunpck1.f/cct3_fokunpck2.f/cct3_fokunpck3.f/cct3_fokunpck4.f/cct3_fokunpck5.f/cct3_getint.f/cct3_getmap.f/cct3_getmediate.f/cct3_grc0.f/cct3_grc22c.f/cct3_grc23c.f/cct3_grc24c.f/cct3_grc32c.f/cct3_grc32y.f/cct3_grc33c.f/cct3_grc34c.f/cct3_grc42c.f/cct3_grc42y.f/cct3_grc43c.f/cct3_grc43y.f/cct3_grc44c.f/cct3_map.f/cct3_map11.f/cct3_map21.f/cct3_map22.f/cct3_map31.f/cct3_map32.f/cct3_map41.f/cct3_map42.f/cct3_mc0c1a3b.f/cct3_mc0c1at3b.f/cct3_mr0u3wt.f/cct3_mult.f/cct3_multc0.f/cct3_multy0.f/cct3_mv0v1a3u.f/cct3_mv0zero.f/cct3_noperm.f/cct3_rea.f/cct3_t3grc0.f/cct3_wri.f/cct3_wrtmap.f/cct3_wrtmediate.f/defv.f/defvhlp1.f/defvhlp21.f/defvhlp22.f/defvhlp3.f/defvhlp4.f/defvhlp51.f/defvhlp52.f/defvhlp53.f/defvhlp54.f/defvhlp61.f/defvhlp62.f/defvhlp7.f/defvhlp81.f/defvhlp82.f/defvhlp9.f/ext.f/exth1.f/exth2.f/exth3.f/exth4.f/exth5.f/getintposs.f/minusa.f/setb.f/stz.f/t31.fh/t32.fh/t3addpck.f/t3aphlp1.f/t3aphlp2.f/t3aphlp3.f/t3aphlp4.f/t3aphlp5.f/t3aphlp6.f/t3aphlp7.f/t3aphlp8.f/t3dhlp1.f/t3dhlp2.f/t3dhlp3.f/t3dhlp4.f/t3div.f/t3gresult.f/t3initfiles.f/t3reaccsd.f/t3reainput.f/t3reaintsta.f/t3sgl.f/t3sglh11.f/t3sglh121.f/t3sglh122.f/t3sglh131.f/t3sglh132.f/t3sglh141.f/t3sglh142.f/t3sglh143.f/t3sglh211.f/t3sglh212.f/t3sglh221.f/t3sglh222.f/t3sglh223.f/t3sglh311.f/t3sglh312.f/t3sglh321.f/t3sglh322.f/t3sglh323.f/t3wresult.f/t3wrhead.f

filetypes:
  fffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/property_util
filetypes: ffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  add_info.F90/add_infoc.c/bragg_slater.F90/charge.F90/chk_vec_uhf.F90/chkvec.F90/cmp_hfc.F90/dens_if.F90/dens_if_scf.F90/dnuclearmass.F90/ecp_shells.F90/fileorb.F90/freeze_default.F90/freq_i.F90/freq_molden.F90/getdens.F90/gfprnt_i.F90/imostabundantisotope.F90/inporbfmt.F90/interf.F90/inuclearchargefromsymbol.F90/isoloop.F90/isotopes.F90/molden_dysorb.F90/molden_interface.F90/nat_bond_order.F90/orb2tpidx.F90/orb2tpidx_sym.F90/orb2tpstr.F90/orb2tpstr_sym.F90/orbtype.F90/primo.F90/prop.F90/prout.F90/prppnt.F90/prpt.F90/prpt_.F90/prpt_old.F90/rdvec.F90/rdvec_.F90/rdvec_hdf5.F90/s2calc.F90/seek_n_destroy.F90/tpidx2orb.F90/tpidx2orb_sym.F90/tpidx2tpstr.F90/tpstr2orb.F90/tpstr2orb_sym.F90/tpstr2tpidx.F90/vdwrad.F90/vecsort.F90/wrvec.F90/wrvec_.F90/xprop.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/dkh_util
filetypes: ffffffffffffffffffffffffffffff
filenames:
  aodkhexp.F90/bss_ts1e.F90/copy_mag_ints.F90/dkh_cofu.F90/dkh_cofu_spec.F90/dkh_geneu.F90/dkh_ham.F90/dkh_info.F90/dkh_prop.F90/dkh_ts1e.F90/dkh_wgene.F90/dkh_woplft.F90/dkh_woprig.F90/dkh_wspec.F90/dkh_xpx.F90/dkrelint_dp.F90/dmxma.F90/merge_mag_ints.F90/x2c_makx.F90/x2c_ts1e.F90/xdr_dmatinv.F90/xdr_dmatsqrt.F90/xdr_fpfw.F90/xdr_fpfwprop.F90/xdr_ham.F90/xdr_indx.F90/xdr_info_local.F90/xdr_local_ham.F90/xdr_mkutls.F90/xdr_prop.F90


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/gugaci
filetypes: ffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  actextloop.f/actploop.f/actsegment.f/arrangeorb.f/calh0.f/ci_parameter.fh/cidiagelm.f/cidiagelm_g.f/cigrad.f/cipro.f/complete_ext_loop.f/config.fh/cont_tmp.fh/count.fh/davdiag.f/dbl_upwalk.f/dblcloop.f/dblcloop_g.f/dblextloop.f/dblploop1.f/dblploop1_g.f/dblploop2.f/dblploop3.f/dblploop4.f/dblploop5.f/dblplpval.f/ddsstt.f/denmat.f/density.fh/drt_h.fh/drtrel.f/dvsdtd.f/extloop1.f/extploop.f/extploop_g.f/files_gugaci.fh/gext_sequence.fh/gpcsf.f/grad_h.fh/grad_xyz.fh/gugaci.f/gugasyscom.f/h0diagonal.f/iaib.fh/innloop.f/innloop_g.f/intsort.f/intsort_h.fh/lgrn.fh/lpdisk.fh/lpextmode_h.fh/main.f/mcorb.fh/molinf.f/mrcimath.f/natureorb.f/ncprhf.fh/newdiag.f/onepl.fh/paraconstants_h.fh/paras_calculate.f/pl_structure_h.fh/prod.f/prod_g.f/prod_util.f/program_control.fh/ptlph.fh/ptlphv.fh/readint.f/ref.fh/scratch.fh/segdrt.f/segvalue.f/sysdep.f/thresh.fh/tvsv.f/vddsdt.f/vect.fh


dirname: /usr/src/debug/OpenMolcas-21.10-2.fc36.s390x/src/gateway_util
filetypes: fffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffffff
filenames:
  AMFI_Info.f90/Basis_Info.f90/Center_Info.f90/Integral_parameters.f90/Logical_Info.f90/Phase_Info.f90/RICD_Info.f90/Real_Info.f90/SOAO_Info.f90/SW_File.f90/Sizes_of_Seward.f90/Symmetry_Info.f90/Temporary_parameters.f90/agin.f/basis2run.f/calcamt.f/clean_bname.f/cow.f/decode.f/dmp_efp.f/dmpinf.f/drvn0.f/dstchk.f/external_centers.f/fetch_qmmm.f/fill_rinfo1.f/findbasis.f/fix_fockop.f/gateway_global.F90/gateway_interfaces.f/gen_geolist.f/geolist.f/geonew.f/geonew_pc.f/getbs.f/getecp.f/getpam.f/index_center.f/index_nosym.f/info2runfile.f/merge_lists.f/mergebs.f/misc.f/mk_chdisp.f/name_to_lm.f/nrmlx.f/nrmlz.f/oeisg.f/one_int.f/order_axis.f/ordexp.f/ordexp1.f/period.f/print_basis.f/print_basis2.f/print_geometry.f/print_isotopes.f/print_opinfo.f/print_symmetry.f/processRP.f/process_weights.f/pso_stuff.F90/rdbsl.f/rdctl_seward.f/rdmx.f/reorder_gw.f/rigrot.f/saddle.f/set_fake_ERIs.f/setup_offAO.f/soctl_seward.f/symmetry.f/vexch.f/vqr.f/xyz.f


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