BSD Portsscience/erd 3.0.6_6 FreeBSD
AcesIII electron repulsion integrals
- System
- FreeBSD
- Repository
- FreeBSD ports
- Maintainer
- [email protected]
- Last update
- Commit
365efad1d0- License
- GPLv2
- Categories
- science
- Package size
- 385.8 KiB, 774.4 KiB installed
Description
Efficient electronic integrals in quantum chemistry, and their generalized derivatives for object oriented implementations of electronic structure calculations.
Based on the paper: * http://onlinelibrary.wiley.com/doi/10.1002/jcc.21018/abstract
In the other systems
| System | Port | Version |
|---|---|---|
| FreeBSD | science/erd | 3.0.6_6 |
| DragonFly | science/erd | 3.0.6_6 |
Install
Binary package:
pkg install erdFrom the ports tree:
cd /usr/ports/science/erd/ && make install cleanTo depend on this port in another port's Makefile:
RUN_DEPENDS= erd>0:science/erd
LIB_DEPENDS= liberd.so:science/erdPackages
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 | 3.0.6_6 | 3.0.6_6 | - | 3.0.6_6 | 3.0.6_6 |
| FreeBSD:14:quarterly | 3.0.6_6 | 3.0.6_6 | n/a | 3.0.6_6 | 3.0.6_6 |
| FreeBSD:15:latest | 3.0.6_6 | 3.0.6_6 | n/a | 3.0.6_6 | 3.0.6_6 |
| FreeBSD:15:quarterly | 3.0.6_6 | 3.0.6_6 | n/a | n/a | n/a |
| FreeBSD:16:latest | 3.0.6_6 | 3.0.6_6 | n/a | n/a | n/a |
| FreeBSD:16:quarterly | n/a | n/a | n/a | n/a | n/a |
Dependencies
The Makefile names none itself; they come from USES and USE_*.
The full lists below include those, and their dependencies in turn.
Build dependencies 17
Run dependencies 8
No port depends on this one.
Configuration
No options to configure.
- USES
- cmake fortran
- Service scripts
- none
Files
pkg-plist 6
- include/ERD/ERD_MANGLE.h
- lib/liberd.so
- share/cmake/erd/erdConfig.cmake
- share/cmake/erd/erdConfigVersion.cmake
- share/cmake/erd/erdTargets-.cmake
- share/cmake/erd/erdTargets.cmake
distinfo 1
| File | Size | SHA256 |
|---|---|---|
| psi4-erd-v3.0.6_GH0.tar.gz | 342362 | ae9a42f7f06bcafad69d95ee66386ccd6ef7b1d1f4f1a2687e6f942245da17de |