Date: Wed, 7 Jun 2023 04:45:31 GMT From: Yuri Victorovich <yuri@FreeBSD.org> To: ports-committers@FreeBSD.org, dev-commits-ports-all@FreeBSD.org, dev-commits-ports-main@FreeBSD.org Subject: git: 68623c5fedf9 - main - =?utf-8?Q?science/tblite:=20Update=200.2.1=20=E2=86=92=200.3.0?= Message-ID: <202306070445.3574jVUY020995@gitrepo.freebsd.org>
next in thread | raw e-mail | index | archive | help
The branch main has been updated by yuri: URL: https://cgit.FreeBSD.org/ports/commit/?id=68623c5fedf9e7bd2434843d3bb651fc2f1ec170 commit 68623c5fedf9e7bd2434843d3bb651fc2f1ec170 Author: Yuri Victorovich <yuri@FreeBSD.org> AuthorDate: 2023-06-07 04:17:37 +0000 Commit: Yuri Victorovich <yuri@FreeBSD.org> CommitDate: 2023-06-07 04:45:25 +0000 science/tblite: Update 0.2.1 → 0.3.0 Reported by: portscout --- science/tblite/Makefile | 3 +-- science/tblite/distinfo | 6 +++--- science/tblite/pkg-plist | 15 +++++++++++++-- 3 files changed, 17 insertions(+), 7 deletions(-) diff --git a/science/tblite/Makefile b/science/tblite/Makefile index 0ac9b18139f3..ab9ac090200a 100644 --- a/science/tblite/Makefile +++ b/science/tblite/Makefile @@ -1,7 +1,6 @@ PORTNAME= tblite DISTVERSIONPREFIX= v -DISTVERSION= 0.2.1 -PORTREVISION= 2 +DISTVERSION= 0.3.0 CATEGORIES= science # chemistry MAINTAINER= yuri@FreeBSD.org diff --git a/science/tblite/distinfo b/science/tblite/distinfo index 785441b04031..45ef1a2c0abb 100644 --- a/science/tblite/distinfo +++ b/science/tblite/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1653189167 -SHA256 (tblite-tblite-v0.2.1_GH0.tar.gz) = 8b803f636685f862097952e7b5e6d0903f6c91b1534c5750664c7ab42a5d4c9a -SIZE (tblite-tblite-v0.2.1_GH0.tar.gz) = 473253 +TIMESTAMP = 1686109155 +SHA256 (tblite-tblite-v0.3.0_GH0.tar.gz) = 44b6ecff94b29c109f7d1afa3f49eebd3979a2b115fc7bab0c9fc1d7e61bdc27 +SIZE (tblite-tblite-v0.3.0_GH0.tar.gz) = 496111 diff --git a/science/tblite/pkg-plist b/science/tblite/pkg-plist index b44816501338..41b65992fc61 100644 --- a/science/tblite/pkg-plist +++ b/science/tblite/pkg-plist @@ -20,6 +20,7 @@ include/tblite/tblite_api_structure.mod include/tblite/tblite_api_table.mod include/tblite/tblite_api_utils.mod include/tblite/tblite_api_version.mod +include/tblite/tblite_basis.mod include/tblite/tblite_basis_ortho.mod include/tblite/tblite_basis_slater.mod include/tblite/tblite_basis_type.mod @@ -34,8 +35,10 @@ include/tblite/tblite_container_list.mod include/tblite/tblite_container_type.mod include/tblite/tblite_context.mod include/tblite/tblite_context_logger.mod +include/tblite/tblite_context_solver.mod include/tblite/tblite_context_terminal.mod include/tblite/tblite_context_type.mod +include/tblite/tblite_coulomb.mod include/tblite/tblite_coulomb_cache.mod include/tblite/tblite_coulomb_charge.mod include/tblite/tblite_coulomb_charge_effective.mod @@ -46,6 +49,7 @@ include/tblite/tblite_coulomb_multipole.mod include/tblite/tblite_coulomb_thirdorder.mod include/tblite/tblite_coulomb_type.mod include/tblite/tblite_cutoff.mod +include/tblite/tblite_data.mod include/tblite/tblite_data_atomicrad.mod include/tblite/tblite_data_covrad.mod include/tblite/tblite_data_paulingen.mod @@ -68,7 +72,11 @@ include/tblite/tblite_lapack.mod include/tblite/tblite_lapack_getrf.mod include/tblite/tblite_lapack_getri.mod include/tblite/tblite_lapack_getrs.mod +include/tblite/tblite_lapack_potrf.mod +include/tblite/tblite_lapack_solver.mod +include/tblite/tblite_lapack_sygst.mod include/tblite/tblite_lapack_sygvd.mod +include/tblite/tblite_lapack_sygvr.mod include/tblite/tblite_mesh_lebedev.mod include/tblite/tblite_ncoord.mod include/tblite/tblite_ncoord_exp.mod @@ -94,9 +102,11 @@ include/tblite/tblite_repulsion_effective.mod include/tblite/tblite_repulsion_type.mod include/tblite/tblite_results.mod include/tblite/tblite_scf.mod -include/tblite/tblite_scf_broyden.mod include/tblite/tblite_scf_info.mod include/tblite/tblite_scf_iterator.mod +include/tblite/tblite_scf_mixer.mod +include/tblite/tblite_scf_mixer_broyden.mod +include/tblite/tblite_scf_mixer_type.mod include/tblite/tblite_scf_potential.mod include/tblite/tblite_scf_solver.mod include/tblite/tblite_solvation.mod @@ -120,6 +130,7 @@ include/tblite/tblite_wavefunction_mulliken.mod include/tblite/tblite_wavefunction_spin.mod include/tblite/tblite_wavefunction_type.mod include/tblite/tblite_wignerseitz.mod +include/tblite/tblite_xtb.mod include/tblite/tblite_xtb_calculator.mod include/tblite/tblite_xtb_coulomb.mod include/tblite/tblite_xtb_gfn1.mod @@ -142,5 +153,5 @@ lib/cmake/tblite/tblite-targets.cmake lib/cmake/tblite/tblite-utils.cmake lib/libtblite.so lib/libtblite.so.0 -lib/libtblite.so.0.2.1 +lib/libtblite.so.0.3.0 libdata/pkgconfig/tblite.pc
Want to link to this message? Use this URL: <https://mail-archive.FreeBSD.org/cgi/mid.cgi?202306070445.3574jVUY020995>