bagel 1.1.0-1 in ubuntu - bionic / universe

About

This package is 33.6 MB. It is available at http://archive.ubuntu.com/ubuntu/pool/universe/b/bagel/bagel_1.1.0-1_amd64.deb .

View its full control file here: debian/control.

Description

Computational Chemistry Package

Relations

Package Contents

File	Mime Type	Owner	Mode	Size
/usr/		root:root	0o755
/usr/bin/		root:root	0o755
/usr/bin/BAGEL	application/x-sharedlib	root:root	0o755	101.9 MB
/usr/share/		root:root	0o755
/usr/share/bagel/		root:root	0o755
/usr/share/bagel/3-21g.json	text/plain	root:root	0o644	64.5 KB
/usr/share/bagel/6-31g.json	text/plain	root:root	0o644	35.4 KB
/usr/share/bagel/ano-rcc.json	text/plain	root:root	0o644	1.7 MB
/usr/share/bagel/aug-cc-pcv5z.json	text/plain	root:root	0o644	52.7 KB
/usr/share/bagel/aug-cc-pcvdz-dk.json	text/plain	root:root	0o644	29.9 KB
/usr/share/bagel/aug-cc-pcvdz.json	text/plain	root:root	0o644	29.6 KB
/usr/share/bagel/aug-cc-pcvqz-dk.json	text/plain	root:root	0o644	61.6 KB
/usr/share/bagel/aug-cc-pcvqz.json	text/plain	root:root	0o644	63.3 KB
/usr/share/bagel/aug-cc-pcvtz-dk.json	text/plain	root:root	0o644	44.6 KB
/usr/share/bagel/aug-cc-pcvtz.json	text/plain	root:root	0o644	46.1 KB
/usr/share/bagel/aug-cc-pv5z.json	text/plain	root:root	0o644	211.0 KB
/usr/share/bagel/aug-cc-pv6z.json	text/plain	root:root	0o644	55.5 KB
/usr/share/bagel/aug-cc-pvdz.json	text/plain	root:root	0o644	107.6 KB
/usr/share/bagel/aug-cc-pvqz.json	text/plain	root:root	0o644	170.5 KB
/usr/share/bagel/aug-cc-pvtz.json	text/plain	root:root	0o644	131.2 KB
/usr/share/bagel/aug-cc-pwcv5z.json	text/plain	root:root	0o644	53.1 KB
/usr/share/bagel/aug-cc-pwcvdz.json	text/plain	root:root	0o644	22.2 KB
/usr/share/bagel/aug-cc-pwcvqz.json	text/plain	root:root	0o644	43.8 KB
/usr/share/bagel/aug-cc-pwcvtz.json	text/plain	root:root	0o644	32.1 KB
/usr/share/bagel/cc-pcv5z.json	text/plain	root:root	0o644	61.3 KB
/usr/share/bagel/cc-pcvdz.json	text/plain	root:root	0o644	28.6 KB
/usr/share/bagel/cc-pcvqz.json	text/plain	root:root	0o644	57.4 KB
/usr/share/bagel/cc-pcvtz.json	text/plain	root:root	0o644	42.0 KB
/usr/share/bagel/cc-pv5z-jkfit.json	text/plain	root:root	0o644	77.2 KB
/usr/share/bagel/cc-pv5z.json	text/plain	root:root	0o644	211.8 KB
/usr/share/bagel/cc-pv5z-ri.json	text/plain	root:root	0o644	67.0 KB
/usr/share/bagel/cc-pv6z.json	text/plain	root:root	0o644	47.2 KB
/usr/share/bagel/cc-pvdz-dk.json	text/plain	root:root	0o644	96.8 KB
/usr/share/bagel/cc-pvdz-jkfit.json	text/plain	root:root	0o644	62.4 KB
/usr/share/bagel/cc-pvdz.json	text/plain	root:root	0o644	100.7 KB
/usr/share/bagel/cc-pvdz-ri.json	text/plain	root:root	0o644	48.0 KB
/usr/share/bagel/cc-pvqz-jkfit.json	text/plain	root:root	0o644	70.7 KB
/usr/share/bagel/cc-pvqz.json	text/plain	root:root	0o644	159.6 KB
/usr/share/bagel/cc-pvqz-ri.json	text/plain	root:root	0o644	77.1 KB
/usr/share/bagel/cc-pvtz-dk.json	text/plain	root:root	0o644	195.5 KB
/usr/share/bagel/cc-pvtz-jkfit.json	text/plain	root:root	0o644	66.5 KB
/usr/share/bagel/cc-pvtz.json	text/plain	root:root	0o644	122.6 KB
/usr/share/bagel/cc-pvtz-ri.json	text/plain	root:root	0o644	62.7 KB
/usr/share/bagel/complete.json	text/plain	root:root	0o644	124.4 KB
/usr/share/bagel/d-aug-cc-pv5z.json	text/plain	root:root	0o644	24.9 KB
/usr/share/bagel/d-aug-cc-pvdz.json	text/plain	root:root	0o644	10.0 KB
/usr/share/bagel/d-aug-cc-pvqz.json	text/plain	root:root	0o644	19.0 KB
/usr/share/bagel/d-aug-cc-pvtz.json	text/plain	root:root	0o644	14.0 KB
/usr/share/bagel/def2-SVP-2c-ecp.json	text/plain	root:root	0o644	3.6 KB
/usr/share/bagel/def2-SVP-ecp.json	text/plain	root:root	0o644	2.8 KB
/usr/share/bagel/ecp10mdf.json	text/plain	root:root	0o644	10.2 KB
/usr/share/bagel/ecp28mdf.json	text/plain	root:root	0o644	7.6 KB
/usr/share/bagel/ecp46mdf.json	text/plain	root:root	0o644	2.6 KB
/usr/share/bagel/ecp60mdf.json	text/plain	root:root	0o644	22.2 KB
/usr/share/bagel/ecp78mdf.json	text/plain	root:root	0o644	2.9 KB
/usr/share/bagel/lanl2dz-ecp.json	text/plain	root:root	0o644	7.2 KB
/usr/share/bagel/qzvpp-jkfit.json	text/plain	root:root	0o644	150.0 KB
/usr/share/bagel/qzvpp.json	text/plain	root:root	0o644	98.7 KB
/usr/share/bagel/sto-3g.json	text/plain	root:root	0o644	58.0 KB
/usr/share/bagel/svp-jkfit.json	text/plain	root:root	0o644	150.0 KB
/usr/share/bagel/svp.json	text/plain	root:root	0o644	43.5 KB
/usr/share/bagel/tzvpp-jkfit.json	text/plain	root:root	0o644	150.0 KB
/usr/share/bagel/tzvpp.json	text/plain	root:root	0o644	64.0 KB
/usr/share/doc/		root:root	0o755
/usr/share/doc/bagel/		root:root	0o755
/usr/share/doc/bagel/changelog.Debian.gz	application/gzip	root:root	0o644	1.1 KB
/usr/share/doc/bagel/copyright	text/plain	root:root	0o644	4.7 KB
/usr/share/doc/bagel/examples/		root:root	0o755
/usr/share/doc/bagel/examples/benzene_sto3g_asd-ras_stack.json	text/plain	root:root	0o644	2.2 KB
/usr/share/doc/bagel/examples/benzene_sto3g_asd_stack.json	text/plain	root:root	0o644	1.9 KB
/usr/share/doc/bagel/examples/benzene_sto3g_asd_T.json	text/plain	root:root	0o644	2.9 KB
/usr/share/doc/bagel/examples/benzene_sto3g_pml.json	text/plain	root:root	0o644	1.2 KB
/usr/share/doc/bagel/examples/benzene_svp_mp2_aux.json	text/plain	root:root	0o644	1.2 KB
/usr/share/doc/bagel/examples/benzene_svp_mp2.json	text/plain	root:root	0o644	1.1 KB
/usr/share/doc/bagel/examples/ch2_sto3g_meci_opt.json	text/plain	root:root	0o644	553 bytes
/usr/share/doc/bagel/examples/cuh2_ecp_hf.json	text/plain	root:root	0o644	518 bytes
/usr/share/doc/bagel/examples/h2o_sto3g_ras_full.json	text/plain	root:root	0o644	638 bytes
/usr/share/doc/bagel/examples/h2o_sto3g_ras_restricted.json	text/plain	root:root	0o644	638 bytes
/usr/share/doc/bagel/examples/h2o_svp_cas.json	text/plain	root:root	0o644	402 bytes
/usr/share/doc/bagel/examples/h2o_svp_fmm.json	text/plain	root:root	0o644	854 bytes
/usr/share/doc/bagel/examples/h2o_svp_fmm_restart.json	text/plain	root:root	0o644	928 bytes
/usr/share/doc/bagel/examples/h2o_svp_nevpt2.json	text/plain	root:root	0o644	560 bytes
/usr/share/doc/bagel/examples/hbr_ecp_sohf.json	text/plain	root:root	0o644	383 bytes
/usr/share/doc/bagel/examples/hcl_svp_common_coulomb.json	text/plain	root:root	0o644	493 bytes
/usr/share/doc/bagel/examples/hcl_svp_common_gaunt.json	text/plain	root:root	0o644	515 bytes
/usr/share/doc/bagel/examples/hcl_svp_dfhf.json	text/plain	root:root	0o644	364 bytes
/usr/share/doc/bagel/examples/hcl_svp_dfhf_opt.json	text/plain	root:root	0o644	415 bytes
/usr/share/doc/bagel/examples/hcl_svp_london_coulomb.json	text/plain	root:root	0o644	653 bytes
/usr/share/doc/bagel/examples/hc_svp_rohf.json	text/plain	root:root	0o644	353 bytes
/usr/share/doc/bagel/examples/hc_svp_rohf_opt.json	text/plain	root:root	0o644	403 bytes
/usr/share/doc/bagel/examples/he3_svp_asd-dmrg.json	text/plain	root:root	0o644	1.4 KB
/usr/share/doc/bagel/examples/he_tzvpp_second_coulomb.json	text/plain	root:root	0o644	320 bytes
/usr/share/doc/bagel/examples/hf_mix2_dfhf.json	text/plain	root:root	0o644	407 bytes
/usr/share/doc/bagel/examples/hf_mix_dfhf_finite.json	text/plain	root:root	0o644	451 bytes
/usr/share/doc/bagel/examples/hf_mix_dfhf.json	text/plain	root:root	0o644	403 bytes
/usr/share/doc/bagel/examples/hf_mix_dfhf_opt.json	text/plain	root:root	0o644	456 bytes
/usr/share/doc/bagel/examples/hf_new_dfhf.json	text/plain	root:root	0o644	444 bytes
/usr/share/doc/bagel/examples/hf_read_mol_cart.json	text/plain	root:root	0o644	164 bytes
/usr/share/doc/bagel/examples/hf_read_mol_sph.json	text/plain	root:root	0o644	141 bytes
/usr/share/doc/bagel/examples/hf_sto3g_fci_dist.json	text/plain	root:root	0o644	404 bytes
/usr/share/doc/bagel/examples/hf_sto3g_fci_hz.json	text/plain	root:root	0o644	404 bytes
/usr/share/doc/bagel/examples/hf_sto3g_fci_kh.json	text/plain	root:root	0o644	403 bytes
/usr/share/doc/bagel/examples/hf_sto3g_fci_restart.json	text/plain	root:root	0o644	448 bytes
/usr/share/doc/bagel/examples/hf_sto3g_relfci_breit.json	text/plain	root:root	0o644	463 bytes
/usr/share/doc/bagel/examples/hf_sto3g_relfci_coulomb.json	text/plain	root:root	0o644	408 bytes
/usr/share/doc/bagel/examples/hf_sto3g_relfci_gaunt.json	text/plain	root:root	0o644	467 bytes
/usr/share/doc/bagel/examples/hf_svp_b3lyp.json	text/plain	root:root	0o644	332 bytes
/usr/share/doc/bagel/examples/hf_svp_b3lyp_opt.json	text/plain	root:root	0o644	387 bytes
/usr/share/doc/bagel/examples/hf_svp_breit.json	text/plain	root:root	0o644	391 bytes
/usr/share/doc/bagel/examples/hf_svp_cas_opt.json	text/plain	root:root	0o644	418 bytes
/usr/share/doc/bagel/examples/hf_svp_cis.json	text/plain	root:root	0o644	371 bytes
/usr/share/doc/bagel/examples/hf_svp_common_dfhf.json	text/plain	root:root	0o644	437 bytes
/usr/share/doc/bagel/examples/hf_svp_coulomb.json	text/plain	root:root	0o644	394 bytes
/usr/share/doc/bagel/examples/hf_svp_coulomb_opt.json	text/plain	root:root	0o644	383 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf_cart.json	text/plain	root:root	0o644	353 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf_charge.json	text/plain	root:root	0o644	512 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf_dkh_grad.json	text/plain	root:root	0o644	395 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf_dkh.json	text/plain	root:root	0o644	347 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf_ext.json	text/plain	root:root	0o644	346 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf.json	text/plain	root:root	0o644	331 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf_opt_cart.json	text/plain	root:root	0o644	408 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf_opt.json	text/plain	root:root	0o644	384 bytes
/usr/share/doc/bagel/examples/hf_svp_dfhf_restart.json	text/plain	root:root	0o644	403 bytes
/usr/share/doc/bagel/examples/hf_svp_gaunt.json	text/plain	root:root	0o644	393 bytes
/usr/share/doc/bagel/examples/hf_svp_hf.json	text/plain	root:root	0o644	319 bytes
/usr/share/doc/bagel/examples/hf_svp_london_coulomb.json	text/plain	root:root	0o644	495 bytes
/usr/share/doc/bagel/examples/hf_svp_london_dfhf.json	text/plain	root:root	0o644	433 bytes
/usr/share/doc/bagel/examples/hf_svp_london_gaunt.json	text/plain	root:root	0o644	519 bytes
/usr/share/doc/bagel/examples/hf_svp_london_hf.json	text/plain	root:root	0o644	422 bytes
/usr/share/doc/bagel/examples/hf_svp_mp2_aux_finite.json	text/plain	root:root	0o644	431 bytes
/usr/share/doc/bagel/examples/hf_svp_mp2_aux_opt.json	text/plain	root:root	0o644	436 bytes
/usr/share/doc/bagel/examples/hf_svp_mp2_opt.json	text/plain	root:root	0o644	404 bytes
/usr/share/doc/bagel/examples/hf_svp_sacas_opt.json	text/plain	root:root	0o644	436 bytes
/usr/share/doc/bagel/examples/hf_svp_second_coulomb.json	text/plain	root:root	0o644	417 bytes
/usr/share/doc/bagel/examples/hf_tzvpp_zcasscf_saveref.json	text/plain	root:root	0o644	1.1 KB
/usr/share/doc/bagel/examples/hf_write_mol_cart.json	text/plain	root:root	0o644	444 bytes
/usr/share/doc/bagel/examples/hf_write_mol_sph.json	text/plain	root:root	0o644	444 bytes
/usr/share/doc/bagel/examples/hhe_svp_fci2_trip.json	text/plain	root:root	0o644	454 bytes
/usr/share/doc/bagel/examples/hhe_svp_fci_hz_trip.json	text/plain	root:root	0o644	482 bytes
/usr/share/doc/bagel/examples/hhe_svp_fci_kh_trip.json	text/plain	root:root	0o644	485 bytes
/usr/share/doc/bagel/examples/hhe_svp_ras_full.json	text/plain	root:root	0o644	585 bytes
/usr/share/doc/bagel/examples/hhe_svp_ras_restricted.json	text/plain	root:root	0o644	584 bytes
/usr/share/doc/bagel/examples/li2_tzvpp_cas43.json	text/plain	root:root	0o644	497 bytes
/usr/share/doc/bagel/examples/lif_svp_cas22.json	text/plain	root:root	0o644	382 bytes
/usr/share/doc/bagel/examples/lif_svp_cas_nacme.json	text/plain	root:root	0o644	402 bytes
/usr/share/doc/bagel/examples/lif_svp_mscaspt2_grad.json	text/plain	root:root	0o644	545 bytes
/usr/share/doc/bagel/examples/lif_svp_xmscaspt2_finite.json	text/plain	root:root	0o644	560 bytes
/usr/share/doc/bagel/examples/lif_svp_xmscaspt2_grad.json	text/plain	root:root	0o644	544 bytes
/usr/share/doc/bagel/examples/lif_svp_xmscaspt2_nacme.json	text/plain	root:root	0o644	561 bytes
/usr/share/doc/bagel/examples/lih_tzvpp_cas22.json	text/plain	root:root	0o644	387 bytes
/usr/share/doc/bagel/examples/nh_svp_triplet_gaunt.json	text/plain	root:root	0o644	520 bytes
/usr/share/doc/bagel/examples/o2_321g_zcasscf_pseudospin.json	text/plain	root:root	0o644	875 bytes
/usr/share/doc/bagel/examples/o2_svp_triplet_breit.json	text/plain	root:root	0o644	569 bytes
/usr/share/doc/bagel/examples/oh_svp_uhf.json	text/plain	root:root	0o644	346 bytes
/usr/share/doc/bagel/examples/oh_svp_uhf_opt.json	text/plain	root:root	0o644	403 bytes
/usr/share/doc/bagel/examples/watertrimer_sto3g_pml_region.json	text/plain	root:root	0o644	955 bytes
/usr/share/doc/bagel/examples/watertrimer_sto3g_rl.json	text/plain	root:root	0o644	919 bytes
/usr/share/doc/bagel/html/		root:root	0o755
/usr/share/doc/bagel/html/asd/		root:root	0o755
/usr/share/doc/bagel/html/asd/asd_dmrg.html	text/html	root:root	0o644	22.7 KB
/usr/share/doc/bagel/html/asd/asd.html	text/html	root:root	0o644	7.8 KB
/usr/share/doc/bagel/html/asd/asd_orbopt.html	text/html	root:root	0o644	11.1 KB
/usr/share/doc/bagel/html/asd/dimer_asd.html	text/html	root:root	0o644	26.2 KB
/usr/share/doc/bagel/html/asd/dimer.html	text/html	root:root	0o644	12.0 KB
/usr/share/doc/bagel/html/asd/multisite.html	text/html	root:root	0o644	8.4 KB
/usr/share/doc/bagel/html/author.html	text/html	root:root	0o644	9.0 KB
/usr/share/doc/bagel/html/ci/		root:root	0o755
/usr/share/doc/bagel/html/ci/ci_methods.html	text/html	root:root	0o644	6.7 KB
/usr/share/doc/bagel/html/ci/fci.html	text/html	root:root	0o644	25.2 KB
/usr/share/doc/bagel/html/ci/rasci.html	text/html	root:root	0o644	17.3 KB
/usr/share/doc/bagel/html/ci/zfci.html	text/html	root:root	0o644	33.3 KB
/usr/share/doc/bagel/html/funding.html	text/html	root:root	0o644	7.1 KB
/usr/share/doc/bagel/html/grad/		root:root	0o755
/usr/share/doc/bagel/html/grad/dynamics.html	text/html	root:root	0o644	21.5 KB
/usr/share/doc/bagel/html/grad/force.html	text/html	root:root	0o644	50.1 KB
/usr/share/doc/bagel/html/grad/grad.html	text/html	root:root	0o644	8.9 KB
/usr/share/doc/bagel/html/grad/hess.html	text/html	root:root	0o644	23.7 KB
/usr/share/doc/bagel/html/grad/methods.html	text/html	root:root	0o644	10.2 KB
/usr/share/doc/bagel/html/_images/		root:root	0o755
/usr/share/doc/bagel/html/_images/bagel-final.png	image/png	root:root	0o644	211.3 KB
/usr/share/doc/bagel/html/_images/benzene_dimer.png	image/png	root:root	0o644	11.2 KB
/usr/share/doc/bagel/html/_images/benzophenone1.png	image/png	root:root	0o644	72.9 KB
/usr/share/doc/bagel/html/_images/benzophenone.png	image/png	root:root	0o644	72.9 KB
/usr/share/doc/bagel/html/_images/funding.png	image/png	root:root	0o644	143.9 KB
/usr/share/doc/bagel/html/_images/group.jpg	image/jpeg	root:root	0o644	278.7 KB
/usr/share/doc/bagel/html/_images/group.png	image/png	root:root	0o644	2.7 MB
/usr/share/doc/bagel/html/_images/hf-graphene.png	image/png	root:root	0o644	47.6 KB
/usr/share/doc/bagel/html/index.html	text/html	root:root	0o644	5.8 KB
/usr/share/doc/bagel/html/miscellaneous/		root:root	0o755
/usr/share/doc/bagel/html/miscellaneous/localization.html	text/html	root:root	0o644	12.0 KB
/usr/share/doc/bagel/html/miscellaneous/misc.html	text/html	root:root	0o644	7.7 KB
/usr/share/doc/bagel/html/miscellaneous/molden.html	text/html	root:root	0o644	10.2 KB
/usr/share/doc/bagel/html/miscellaneous/moprint.html	text/html	root:root	0o644	16.2 KB
/usr/share/doc/bagel/html/miscellaneous/save_ref.html	text/html	root:root	0o644	18.5 KB
/usr/share/doc/bagel/html/molecule/		root:root	0o755
/usr/share/doc/bagel/html/molecule/molecule.html	text/html	root:root	0o644	55.3 KB
/usr/share/doc/bagel/html/molecule/molecule-toc.html	text/html	root:root	0o644	8.1 KB
/usr/share/doc/bagel/html/multi/		root:root	0o755
/usr/share/doc/bagel/html/multi/casscf.html	text/html	root:root	0o644	39.0 KB
/usr/share/doc/bagel/html/multi/multi.html	text/html	root:root	0o644	7.3 KB
/usr/share/doc/bagel/html/multi/zcasscf.html	text/html	root:root	0o644	49.1 KB
/usr/share/doc/bagel/html/opt/		root:root	0o755
/usr/share/doc/bagel/html/opt/optimize.html	text/html	root:root	0o644	46.6 KB
/usr/share/doc/bagel/html/pt2/		root:root	0o755
/usr/share/doc/bagel/html/pt2/caspt2.html	text/html	root:root	0o644	7.6 KB
/usr/share/doc/bagel/html/pt2/mp2.html	text/html	root:root	0o644	19.7 KB
/usr/share/doc/bagel/html/pt2/nevpt2.html	text/html	root:root	0o644	14.3 KB
/usr/share/doc/bagel/html/pt2/pt2.html	text/html	root:root	0o644	7.8 KB
/usr/share/doc/bagel/html/pt2/relcaspt2.html	text/html	root:root	0o644	7.5 KB
/usr/share/doc/bagel/html/quickstart/		root:root	0o755
/usr/share/doc/bagel/html/quickstart/how_to_run_bagel.html	text/html	root:root	0o644	23.8 KB
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