在 buster 发行版中 all 硬件架构下的 aces3-data 软件包文件清单

/usr/share/aces3/GENBAS
/usr/share/aces3/sio/.gitkeep
/usr/share/aces3/sio/2_dens_eom_uhf_template.sio
/usr/share/aces3/sio/F12_2el_tran_rhf.sio
/usr/share/aces3/sio/F12_multiint.sio
/usr/share/aces3/sio/F12_multiint_ccsd.sio
/usr/share/aces3/sio/F12_multiint_ccsd_fc.sio
/usr/share/aces3/sio/ccsd_rhf_ao_sv1_diis5.sio
/usr/share/aces3/sio/ccsd_rhf_ao_sv1_diis5_F12.sio
/usr/share/aces3/sio/ccsd_rhf_ao_sv1_diis5_F12_fc.sio
/usr/share/aces3/sio/ccsd_rhf_ao_sv1_diis5_kraken.sio
/usr/share/aces3/sio/ccsd_rhf_grad.sio
/usr/share/aces3/sio/ccsd_rhf_grad_works.sio
/usr/share/aces3/sio/ccsd_sv1.sio
/usr/share/aces3/sio/ccsd_sv3.sio
/usr/share/aces3/sio/ccsd_svall-T.sio
/usr/share/aces3/sio/ccsd_svtry1.sio
/usr/share/aces3/sio/ccsd_uhf_MO.sio
/usr/share/aces3/sio/ccsd_uhf_MO_sv1.sio
/usr/share/aces3/sio/ccsd_uhf_ao_dist1.sio
/usr/share/aces3/sio/ccsd_uhf_ao_dist1_diis5.sio
/usr/share/aces3/sio/ccsd_uhf_ao_dtest1.sio
/usr/share/aces3/sio/ccsd_uhf_ao_dtest1_mem.sio
/usr/share/aces3/sio/ccsd_uhf_ao_dtest3.sio
/usr/share/aces3/sio/ccsd_uhf_ao_dtest5.sio
/usr/share/aces3/sio/ccsd_uhf_ao_dtest6.sio
/usr/share/aces3/sio/ccsd_uhf_ao_dtest7.sio
/usr/share/aces3/sio/ccsd_uhf_ao_mosymm1.sio
/usr/share/aces3/sio/ccsd_uhf_ao_p1_d.sio
/usr/share/aces3/sio/ccsd_uhf_ao_p1_do1.sio
/usr/share/aces3/sio/ccsd_uhf_ao_p1_do2.sio
/usr/share/aces3/sio/ccsd_uhf_ao_p1_do3.sio
/usr/share/aces3/sio/ccsd_uhf_ao_p1_so1.sio
/usr/share/aces3/sio/ccsd_uhf_ao_sv1.sio
/usr/share/aces3/sio/ccsd_uhf_ao_sv1_diis5.sio
/usr/share/aces3/sio/ccsd_uhf_ao_sv2_diis5.sio
/usr/share/aces3/sio/ccsd_uhf_ao_v7.sio
/usr/share/aces3/sio/ccsd_uhf_aop1.sio
/usr/share/aces3/sio/ccsd_uhf_aop2.sio
/usr/share/aces3/sio/ccsd_uhf_dea.sio
/usr/share/aces3/sio/ccsd_uhf_dip.sio
/usr/share/aces3/sio/ccsd_uhf_dropmo.sio
/usr/share/aces3/sio/ccsd_uhf_grad.sio
/usr/share/aces3/sio/ccsd_uhf_mo_dist1.sio
/usr/share/aces3/sio/ccsd_uhf_mo_dist1_diis5.sio
/usr/share/aces3/sio/ccsd_uhf_mo_p1_do1.sio
/usr/share/aces3/sio/ccsd_uhf_mo_so1.sio
/usr/share/aces3/sio/ccsd_uhf_mo_sv1.sio
/usr/share/aces3/sio/ccsd_uhf_mo_sv1_diis5.sio
/usr/share/aces3/sio/ccsd_uhf_stingy1_mosymm.sio
/usr/share/aces3/sio/ccsd_uhf_stingy2.sio
/usr/share/aces3/sio/ccsd_uhf_stingy2_mosymm.sio
/usr/share/aces3/sio/ccsd_uhf_stingy3.sio
/usr/share/aces3/sio/ccsdpt_rhf_aaa_new.sio
/usr/share/aces3/sio/ccsdpt_rhf_aaa_new_dist1.sio
/usr/share/aces3/sio/ccsdpt_rhf_aab_new.sio
/usr/share/aces3/sio/ccsdpt_rhf_aab_new_dist1.sio
/usr/share/aces3/sio/ccsdpt_rhf_pp.sio
/usr/share/aces3/sio/ccsdpt_rhf_pp_new4.sio
/usr/share/aces3/sio/ccsdpt_uhf_aax_new.sio
/usr/share/aces3/sio/ccsdpt_uhf_bbx_new.sio
/usr/share/aces3/sio/ccsdpt_uhf_d2_p1.sio
/usr/share/aces3/sio/ccsdpt_uhf_pp.sio
/usr/share/aces3/sio/ccsdpt_uhf_sv1.sio
/usr/share/aces3/sio/cis_d_rhf.sio
/usr/share/aces3/sio/cis_lccd_rhf.sio
/usr/share/aces3/sio/cis_lccd_rhf_1.sio
/usr/share/aces3/sio/cis_lccd_rhf_10.sio
/usr/share/aces3/sio/cis_lccd_rhf_2.sio
/usr/share/aces3/sio/cis_lccd_rhf_3.sio
/usr/share/aces3/sio/cis_lccd_rhf_4.sio
/usr/share/aces3/sio/cis_lccd_rhf_5.sio
/usr/share/aces3/sio/cis_lccd_rhf_6.sio
/usr/share/aces3/sio/cis_lccd_rhf_7.sio
/usr/share/aces3/sio/cis_lccd_rhf_8.sio
/usr/share/aces3/sio/cis_lccd_rhf_9.sio
/usr/share/aces3/sio/cis_rhf.sio
/usr/share/aces3/sio/cis_rhf_dens.sio
/usr/share/aces3/sio/cis_uhf.sio
/usr/share/aces3/sio/cis_uhf_dens.sio
/usr/share/aces3/sio/default_jobflows
/usr/share/aces3/sio/dtest1_mem.sio
/usr/share/aces3/sio/ea_eomcc.sio
/usr/share/aces3/sio/eccsd_rhf.sio
/usr/share/aces3/sio/eccsd_uhf.sio
/usr/share/aces3/sio/elambda_rhf.sio
/usr/share/aces3/sio/elambda_uhf_ao_sv1.sio
/usr/share/aces3/sio/eom_1_2_density_rhf.sio
/usr/share/aces3/sio/eom_dea.sio
/usr/share/aces3/sio/eom_dea_left_singlets.sio
/usr/share/aces3/sio/eom_dea_left_triplets.sio
/usr/share/aces3/sio/eom_dea_singlets.sio
/usr/share/aces3/sio/eom_dea_singlets_hpc.sio
/usr/share/aces3/sio/eom_dea_triplets.sio
/usr/share/aces3/sio/eom_dea_triplets_hpc.sio
/usr/share/aces3/sio/eom_dip.sio
/usr/share/aces3/sio/eom_dip_left_singlets.sio
/usr/share/aces3/sio/eom_dip_left_triplets.sio
/usr/share/aces3/sio/eom_dip_singlets.sio
/usr/share/aces3/sio/eom_dip_triplets.sio
/usr/share/aces3/sio/eomccsd_density_rhf.sio
/usr/share/aces3/sio/eomccsd_density_uhf.sio
/usr/share/aces3/sio/eomccsd_rhf_grad.sio
/usr/share/aces3/sio/eomccsd_uhf_ao.sio
/usr/share/aces3/sio/eomccsd_uhf_grad.sio
/usr/share/aces3/sio/eomccsd_uhf_mo.sio
/usr/share/aces3/sio/eomccsdpt_rhf_aaa.sio
/usr/share/aces3/sio/eomccsdpt_rhf_aab.sio
/usr/share/aces3/sio/etran_rhf.sio
/usr/share/aces3/sio/expand_cc.sio
/usr/share/aces3/sio/expand_ccsd_rhf.sio
/usr/share/aces3/sio/expand_lccd_rhf.sio
/usr/share/aces3/sio/expand_lccd_uhf.sio
/usr/share/aces3/sio/fno_rhf_mp2.sio
/usr/share/aces3/sio/gradscf.sio
/usr/share/aces3/sio/hbar_uhf_ao.sio
/usr/share/aces3/sio/hbar_uhf_ao_eaeomcc.sio
/usr/share/aces3/sio/hbar_uhf_ao_ipeomcc.sio
/usr/share/aces3/sio/hbar_uhf_ao_ipeomcc_F12.sio
/usr/share/aces3/sio/hbar_uhf_dea.sio
/usr/share/aces3/sio/hbar_uhf_mo.sio
/usr/share/aces3/sio/hess_rhf_mp2_seg.sio
/usr/share/aces3/sio/hess_rhf_sv1_ao1.sio
/usr/share/aces3/sio/hess_uhf_alt.sio
/usr/share/aces3/sio/hess_uhf_mp2_seg.sio
/usr/share/aces3/sio/hess_uhf_mp2_seg_1.sio
/usr/share/aces3/sio/hess_uhf_mp2_seg_2.sio
/usr/share/aces3/sio/hess_uhf_scf.sio
/usr/share/aces3/sio/hess_uhf_sv1_ao1.sio
/usr/share/aces3/sio/interm_F12_ccsd.sio
/usr/share/aces3/sio/interm_F12_ccsd_fc.sio
/usr/share/aces3/sio/ip_eomcc.sio
/usr/share/aces3/sio/ip_eomcc_F12.sio
/usr/share/aces3/sio/ip_eomcc_dav_F12.sio
/usr/share/aces3/sio/ip_eomcc_dav_trip_F12.sio
/usr/share/aces3/sio/lambdaT_uhf_ao_sv1.sio
/usr/share/aces3/sio/lambda_ao3_mosymm.sio
/usr/share/aces3/sio/lambda_mo.sio
/usr/share/aces3/sio/lambda_rhf.sio
/usr/share/aces3/sio/lambda_rhf_dropmo_new.sio
/usr/share/aces3/sio/lambda_rhf_posteom_4dens.sio
/usr/share/aces3/sio/lambda_sv1.sio
/usr/share/aces3/sio/lambda_uhf_ao_dist1.sio
/usr/share/aces3/sio/lambda_uhf_ao_dist1_diis5.sio
/usr/share/aces3/sio/lambda_uhf_ao_sv1.sio
/usr/share/aces3/sio/lambda_uhf_ao_sv1_diis5.sio
/usr/share/aces3/sio/lambda_uhf_ao_sv1_new.sio
/usr/share/aces3/sio/lambda_uhf_ao_sv2_diis5.sio
/usr/share/aces3/sio/lambda_uhf_dropmo.sio
/usr/share/aces3/sio/lambda_uhf_dropmo_new.sio
/usr/share/aces3/sio/lambda_uhf_mo_dist1.sio
/usr/share/aces3/sio/lambda_uhf_mo_dist1_diis5.sio
/usr/share/aces3/sio/lambda_uhf_mo_sv1.sio
/usr/share/aces3/sio/lambda_uhf_mo_sv1_diis5.sio
/usr/share/aces3/sio/lambda_uhf_posteom_4dens.sio
/usr/share/aces3/sio/lambda_uhf_rprint.sio
/usr/share/aces3/sio/lccd_g1_rhf.sio
/usr/share/aces3/sio/lccd_g1_uhf.sio
/usr/share/aces3/sio/lccd_g2_densstore_rhf.sio
/usr/share/aces3/sio/lccd_g2_densstore_uhf.sio
/usr/share/aces3/sio/lccd_g2_rhf.sio
/usr/share/aces3/sio/lccd_g2_uhf.sio
/usr/share/aces3/sio/lccd_gtran_rhf.sio
/usr/share/aces3/sio/lccd_gtran_uhf.sio
/usr/share/aces3/sio/lccd_rhf.sio
/usr/share/aces3/sio/lccd_rhf_dipole.sio
/usr/share/aces3/sio/lccd_rhf_noniter.sio
/usr/share/aces3/sio/lccd_rhf_opt.sio
/usr/share/aces3/sio/lccd_uhf.sio
/usr/share/aces3/sio/lccsdpt_aaa_psect.sio
/usr/share/aces3/sio/lccsdpt_aab_psect.sio
/usr/share/aces3/sio/lccsdpt_rhf_aaa.sio
/usr/share/aces3/sio/lccsdpt_rhf_aab.sio
/usr/share/aces3/sio/leom_rhf.sio
/usr/share/aces3/sio/leom_uhf.sio
/usr/share/aces3/sio/leomccsdpr_rhf_aaa.sio
/usr/share/aces3/sio/leomccsdpr_rhf_aab.sio
/usr/share/aces3/sio/leomccsdpt_aaa_psect.sio
/usr/share/aces3/sio/leomccsdpt_aab_psect.sio
/usr/share/aces3/sio/ltemp_aaa_nodshift.sio
/usr/share/aces3/sio/ltemp_aab_nodshift.sio
/usr/share/aces3/sio/mp2_F12.sio
/usr/share/aces3/sio/mp2_F12_fc.sio
/usr/share/aces3/sio/mp2_grad_ao2.sio
/usr/share/aces3/sio/mp2_grad_ao2_Tsymm.sio
/usr/share/aces3/sio/mp2_n5_rhf.sio
/usr/share/aces3/sio/mp2_n6_rhf.sio
/usr/share/aces3/sio/mp2_n6_rhf_symm.opt.sio
/usr/share/aces3/sio/mp2_n6_rhf_symm.sio
/usr/share/aces3/sio/mp2_n6_uhf.sio
/usr/share/aces3/sio/mp2_n6_uhf_symm.sio
/usr/share/aces3/sio/mp2_rhf_sp.sio
/usr/share/aces3/sio/mp2_uhf_ls1.sio
/usr/share/aces3/sio/mp2_uhf_sp.sio
/usr/share/aces3/sio/mp2grad_rhf.sio
/usr/share/aces3/sio/mp2grad_rhf_bg.sio
/usr/share/aces3/sio/mp2grad_rhf_hp.sio
/usr/share/aces3/sio/mp2grad_rhf_lp.sio
/usr/share/aces3/sio/mp2grad_rhf_lp_dist.sio
/usr/share/aces3/sio/mp2grad_rhf_lp_ld.sio
/usr/share/aces3/sio/mp2grad_rhf_lp_ld_dist.sio
/usr/share/aces3/sio/mp2grad_rhf_sv1.sio
/usr/share/aces3/sio/mp2grad_rhf_sv1_new.sio
/usr/share/aces3/sio/mp2grad_uhf.sio
/usr/share/aces3/sio/mp2grad_uhf_hp.sio
/usr/share/aces3/sio/mp2grad_uhf_sv1.sio
/usr/share/aces3/sio/mp2grad_uhf_sv1_new.sio
/usr/share/aces3/sio/mp2gradtest.sio
/usr/share/aces3/sio/oldvccs.sio
/usr/share/aces3/sio/one_grad.sio
/usr/share/aces3/sio/one_grad_co.sio
/usr/share/aces3/sio/one_grad_herm_rhf_ao_sv1.sio
/usr/share/aces3/sio/one_grad_herm_rhf_ao_sv1_dropmo.sio
/usr/share/aces3/sio/one_grad_herm_uhf_ao_sv1_diis5.sio
/usr/share/aces3/sio/one_grad_herm_uhf_ao_sv1_dropmo_diis5.sio
/usr/share/aces3/sio/one_grad_rhf_ao_sv1.sio
/usr/share/aces3/sio/one_grad_rhf_ao_sv1_dropmo.sio
/usr/share/aces3/sio/one_grad_sv1.sio
/usr/share/aces3/sio/one_grad_uhf_ao_dist1.sio
/usr/share/aces3/sio/one_grad_uhf_ao_dist1_diis5.sio
/usr/share/aces3/sio/one_grad_uhf_ao_sv1.sio
/usr/share/aces3/sio/one_grad_uhf_ao_sv1_diis5.sio
/usr/share/aces3/sio/one_grad_uhf_ao_sv1_dropmo_diis5.sio
/usr/share/aces3/sio/one_grad_uhf_mo_dist1.sio
/usr/share/aces3/sio/one_grad_uhf_mo_dist1_diis5.sio
/usr/share/aces3/sio/one_grad_uhf_mo_sv1.sio
/usr/share/aces3/sio/one_grad_uhf_mo_sv1_diis5.sio
/usr/share/aces3/sio/one_test.sio
/usr/share/aces3/sio/pccsd_g1.sio
/usr/share/aces3/sio/pccsd_g2.sio
/usr/share/aces3/sio/pccsd_o1g.sio
/usr/share/aces3/sio/pccsd_tran.sio
/usr/share/aces3/sio/rccsd_rhf.sio
/usr/share/aces3/sio/rccsd_uhf.sio
/usr/share/aces3/sio/rccsdpt_aaa.sio
/usr/share/aces3/sio/rccsdpt_aaa_1s.sio
/usr/share/aces3/sio/rccsdpt_aaa_F12.sio
/usr/share/aces3/sio/rccsdpt_aaa_psect.sio
/usr/share/aces3/sio/rccsdpt_aab.sio
/usr/share/aces3/sio/rccsdpt_aab_1s.sio
/usr/share/aces3/sio/rccsdpt_aab_F12.sio
/usr/share/aces3/sio/rccsdpt_aab_psect.sio
/usr/share/aces3/sio/rccsdpt_sub_aaa.sio
/usr/share/aces3/sio/rccsdpt_sub_aab.sio
/usr/share/aces3/sio/reom_rhf.sio
/usr/share/aces3/sio/reom_rhf_printvec_4dens.sio
/usr/share/aces3/sio/reom_rhf_prop.sio
/usr/share/aces3/sio/reom_uhf.sio
/usr/share/aces3/sio/reom_uhf_printvec_4dens.sio
/usr/share/aces3/sio/reom_uhf_prop.sio
/usr/share/aces3/sio/rohf_tran.sio
/usr/share/aces3/sio/scf_aguess.sio
/usr/share/aces3/sio/scf_ccsd_rhf.sio
/usr/share/aces3/sio/scf_comp_rud.sio
/usr/share/aces3/sio/scf_nj_disktest.sio
/usr/share/aces3/sio/scf_nj_networkfirst.sio
/usr/share/aces3/sio/scf_nj_onlydisk.sio
/usr/share/aces3/sio/scf_nj_onlynetwork.sio
/usr/share/aces3/sio/scf_nj_onlyprepare.sio
/usr/share/aces3/sio/scf_nj_onlypreparetemp.sio
/usr/share/aces3/sio/scf_qrhf_aguess.sio
/usr/share/aces3/sio/scf_rhf_aguess.sio
/usr/share/aces3/sio/scf_rhf_aguess_afock.sio
/usr/share/aces3/sio/scf_rhf_aguess_opt.sio
/usr/share/aces3/sio/scf_rhf_aguess_quadc.sio
/usr/share/aces3/sio/scf_rhf_coreh.sio
/usr/share/aces3/sio/scf_rhf_fast.sio
/usr/share/aces3/sio/scf_rhf_gorb.sio
/usr/share/aces3/sio/scf_rhf_isymm_diis10.sio
/usr/share/aces3/sio/scf_rhf_new.sio
/usr/share/aces3/sio/scf_rud_model.sio
/usr/share/aces3/sio/scf_uhf_aguess.sio
/usr/share/aces3/sio/scf_uhf_aguess_opt.sio
/usr/share/aces3/sio/scf_uhf_aguess_tom.sio
/usr/share/aces3/sio/scf_uhf_ainit_aguess.sio
/usr/share/aces3/sio/scf_uhf_binit_aguess.sio
/usr/share/aces3/sio/scf_uhf_coreh.sio
/usr/share/aces3/sio/scf_uhf_fast.sio
/usr/share/aces3/sio/scf_uhf_finish.sio
/usr/share/aces3/sio/scf_uhf_finish_aguess.sio
/usr/share/aces3/sio/scf_uhf_gorb.sio
/usr/share/aces3/sio/scf_uhf_init.sio
/usr/share/aces3/sio/scf_uhf_isymm.sio
/usr/share/aces3/sio/scf_uhf_isymm_diis10.sio
/usr/share/aces3/sio/scf_uhf_new.sio
/usr/share/aces3/sio/scf_uhf_vccs_aguess.sio
/usr/share/aces3/sio/scf_vccs_aguess_uhf.sio
/usr/share/aces3/sio/scf_vccs_uhf.sio
/usr/share/aces3/sio/scftest_0.sio
/usr/share/aces3/sio/scftest_1a.sio
/usr/share/aces3/sio/scftest_1b.sio
/usr/share/aces3/sio/scftest_1c.sio
/usr/share/aces3/sio/scftest_2a.sio
/usr/share/aces3/sio/scftest_2b.sio
/usr/share/aces3/sio/scftest_2c.sio
/usr/share/aces3/sio/scftest_2d.sio
/usr/share/aces3/sio/scftest_2e.sio
/usr/share/aces3/sio/scftest_2f.sio
/usr/share/aces3/sio/scftest_3.sio
/usr/share/aces3/sio/scftest_nop.sio
/usr/share/aces3/sio/scftest_xx.sio
/usr/share/aces3/sio/sial_config
/usr/share/aces3/sio/soi_timings.sio
/usr/share/aces3/sio/spnorbt_cc_uhf_1p.sio
/usr/share/aces3/sio/spnorbt_cc_uhf_2p.sio
/usr/share/aces3/sio/stingy1_ccsd.sio
/usr/share/aces3/sio/stingy1_served_ccsd.sio
/usr/share/aces3/sio/tccs.sio
/usr/share/aces3/sio/temp.sio
/usr/share/aces3/sio/temp5.sio
/usr/share/aces3/sio/temp6.sio
/usr/share/aces3/sio/temp7.sio
/usr/share/aces3/sio/temp_ref.sio
/usr/share/aces3/sio/temp_ref_opt.sio
/usr/share/aces3/sio/temp_sub.sio
/usr/share/aces3/sio/test_vccs.sio
/usr/share/aces3/sio/tran_rhf_ao_sv1.sio
/usr/share/aces3/sio/tran_rhf_ao_sv1_F12.sio
/usr/share/aces3/sio/tran_rhf_ao_sv1_F12_fc.sio
/usr/share/aces3/sio/tran_rhf_expanded.sio
/usr/share/aces3/sio/tran_sv1.sio
/usr/share/aces3/sio/tran_uhf_ao_dist1.sio
/usr/share/aces3/sio/tran_uhf_ao_sv1.sio
/usr/share/aces3/sio/tran_uhf_dea.sio
/usr/share/aces3/sio/tran_uhf_dip.sio
/usr/share/aces3/sio/tran_uhf_expanded.sio
/usr/share/aces3/sio/tran_uhf_mo_dist1.sio
/usr/share/aces3/sio/tran_uhf_mo_sv1.sio
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