BSD Portsscience/libint2 2.12.0_1 FreeBSD
Evaluate the integrals in modern atomic and molecular theory
- System
- FreeBSD
- Repository
- FreeBSD ports
- Maintainer
- [email protected]
- Last update
- Commit
97a84ef467- License
- GPLv2
- Categories
- science
- Package size
- 17773.8 KiB, 74281.9 KiB installed
Description
Libint is a library for evaluating ERI (electron replusion integral) over Cartesian Gaussian fuctions for modern atomic and molecular theory.
Install
Binary package:
pkg install libint2From the ports tree:
cd /usr/ports/science/libint2/ && make install cleanTo depend on this port in another port's Makefile:
RUN_DEPENDS= libint2>0:science/libint2
LIB_DEPENDS= libint2.so:science/libint2Packages
The version each package repository carries. “-” means the repository builds no package of it, “n/a” that there is no such repository.
| Repository | aarch64 | amd64 | armv6 | armv7 | i386 |
|---|---|---|---|---|---|
| FreeBSD:14:latest | 2.12.0_1 | 2.12.0_1 | 2.7.2_1 | 2.11.0_1 | 2.12.0_1 |
| FreeBSD:14:quarterly | 2.12.0_1 | 2.12.0_1 | n/a | 2.11.0_1 | 2.12.0_1 |
| FreeBSD:15:latest | 2.12.0_1 | 2.12.0_1 | n/a | 2.11.0_1 | 2.11.0_1 |
| FreeBSD:15:quarterly | 2.12.0_1 | 2.12.0_1 | n/a | n/a | n/a |
| FreeBSD:16:latest | 2.12.0_1 | 2.12.0_1 | n/a | n/a | n/a |
| FreeBSD:16:quarterly | n/a | n/a | n/a | n/a | n/a |
Dependencies
As this port's Makefile names them.
Library 2
libboost_thread.so: devel/boost-libslibgmpxx.so: math/gmp
The full lists below include those, and their dependencies in turn.
Build dependencies 14
Required by 1
Configuration
Options name: science_libint
| Option | Default | Description |
|---|---|---|
| STATIC | off | Build static executables and/or libraries |
- USES
- autoreconf:build compiler:c++11-lang gmake libtool localbase:ldflags
- Service scripts
- none
Files
pkg-plist 165
- include/libint2.h
- include/libint2.hpp
- include/libint2/GenericContract.h
- include/libint2/GenericGaussDeriv.h
- include/libint2/GenericGaussDeriv.impl.h
- include/libint2/GenericScale.h
- include/libint2/ITR_xs_xs.h
- include/libint2/OSVRR_sx_sx.h
- include/libint2/OSVRR_sx_sx_deriv.h
- include/libint2/OSVRR_xs_xs.h
- include/libint2/OSVRR_xs_xs_deriv.h
- include/libint2/VRR_GTG_1d_xx_xx.h
- include/libint2/VRR_GTG_1d_xx_xx_vec.h
- include/libint2/VRR_r12kg12_xs_xs.h
- include/libint2/atom.h
- include/libint2/basis.h
- include/libint2/boys.h
- include/libint2/boys_cheb7.h
- include/libint2/boys_cheb7_v2.h
- include/libint2/boys_fwd.h
- include/libint2/braket.h
- include/libint2/cartesian.h
- include/libint2/cgshell_ordering.h
- include/libint2/cgshellinfo.h
- include/libint2/chemistry/elements.h
- include/libint2/chemistry/sto3g_atomic_density.h
- include/libint2/config.h
- include/libint2/cxxapi.h
- include/libint2/deriv_iter.h
- include/libint2/deriv_map.h
- include/libint2/dfbs_generator.h
- include/libint2/diis.h
- include/libint2/engine.h
- include/libint2/engine.impl.h
- include/libint2/initialize.h
- include/libint2/lcao/1body.h
- include/libint2/lcao/molden.h
- include/libint2/libint2_iface.h
- include/libint2/libint2_params.h
- include/libint2/libint2_types.h
- include/libint2/numeric.h
- include/libint2/pivoted_cholesky.h
- include/libint2/shell.h
- include/libint2/shgshell_ordering.h
- include/libint2/soad_fock.h
- include/libint2/solidharmonics.h
- include/libint2/statics_definition.h
- include/libint2/tenno_cheb.h
- include/libint2/tenno_cheb15.h
- include/libint2/tensor.h
- include/libint2/util/any.h
- include/libint2/util/array_adaptor.h
- include/libint2/util/compressed_pair.h
- include/libint2/util/configuration.h
- include/libint2/util/cxxstd.h
- include/libint2/util/deprecated.h
- include/libint2/util/generated/libint2_iface.h
- include/libint2/util/generated/libint2_params.h
- include/libint2/util/generated/libint2_types.h
- include/libint2/util/intpart_iter.h
- include/libint2/util/intrinsic_operations.h
- include/libint2/util/intrinsic_types.h
- include/libint2/util/memory.h
- include/libint2/util/optional.h
- include/libint2/util/singleton.h
- include/libint2/util/small_vector.h
- include/libint2/util/timer.h
- include/libint2/util/type_traits.h
- include/libint2/util/vector.h
- include/libint2/util/vector_ppc.h
- include/libint2/util/vector_x86.h
- lib/libint2.so
- lib/libint2.so.2
- lib/libint2.so.2.0.3
- libdata/pkgconfig/libint2.pc
- share/libint2/%%VER%%/basis/3-21g.g94
- share/libint2/%%VER%%/basis/6-311g**.g94
- share/libint2/%%VER%%/basis/6-311gss.g94
- share/libint2/%%VER%%/basis/6-31g**.g94
- share/libint2/%%VER%%/basis/6-31g*.g94
- share/libint2/%%VER%%/basis/6-31g.g94
- share/libint2/%%VER%%/basis/6-31gs.g94
- share/libint2/%%VER%%/basis/6-31gss.g94
- share/libint2/%%VER%%/basis/ano-rcc-mb.g94
- share/libint2/%%VER%%/basis/ano-rcc.g94
- share/libint2/%%VER%%/basis/aug-cc-pv5z-cabs.g94
- share/libint2/%%VER%%/basis/aug-cc-pvdz-cabs.g94
- share/libint2/%%VER%%/basis/aug-cc-pvqz-cabs.g94
- share/libint2/%%VER%%/basis/aug-cc-pvtz-cabs.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pv5z-jkfit.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pv5z-ri.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pv5z.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pv6z-ri.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pv6z.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pv7z.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pvdz-jkfit.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pvdz-ri.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pvdz.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pvqz-jkfit.g94
- share/libint2/%%VER%%/basis/augmentation-cc-pvqz-ri.g94
The first 100 are listed.
distinfo 1
| File | Size | SHA256 |
|---|---|---|
| evaleev-libint-v2.12.0_GH0.tar.gz | 2.1962025e+07 | 732988a1ea95eb4eae91bcb2b2a718d95dc5caca41533746fc4111532d55ae74 |