elkcode 2.2.10-1 source package in Ubuntu
Changelog
elkcode (2.2.10-1) unstable; urgency=low * New upstream release. * debian/control (Standards-Version): Bumped to 3.9.5. -- Debichem Team <email address hidden> Sun, 15 Dec 2013 20:40:07 +0100
Upload details
- Uploaded by:
- Debichem Team
- Uploaded to:
- Sid
- Original maintainer:
- Debichem Team
- Architectures:
- any
- Section:
- misc
- Urgency:
- Low Urgency
See full publishing history Publishing
| Series | Published | Component | Section | |
|---|---|---|---|---|
| Trusty | release | universe | misc |
Downloads
| File | Size | SHA-256 Checksum |
|---|---|---|
| elkcode_2.2.10-1.dsc | 1.3 KiB | 52f1227cd7b53d825005377051749dace322a2ddb23547d4cbd448db972e08a7 |
| elkcode_2.2.10.orig.tar.gz | 1.9 MiB | 6e344e02cf4aee96ebf86cb4a26c9a61f452b469e60cad67645e07ea5e529ce0 |
| elkcode_2.2.10-1.debian.tar.gz | 8.0 KiB | 08dd2cddd274c7c4be190754e1071ce3669234c846074b8174c1da46f68bfd13 |
Available diffs
- diff from 2.2.5-1 to 2.2.10-1 (61.1 KiB)
- diff from 2.2.5-1build1 (in Ubuntu) to 2.2.10-1 (61.2 KiB)
No changes file available.
Binary packages built by this source
- elk-lapw: All-Electron Density-Functional Electronic Structure Code
Elk is an all-electron full-potential linearised augmented-plane wave
(FP-LAPW) code. By not including pseudo-potentials, Elk can provide very
reliable high-precision results and works for every chemical element. Features
include:
.
* FP-LAPW basis with local-orbitals
* APW radial derivative matching to arbitrary orders at muffin-tin surface
(super-LAPW, etc.)
* Arbitrary number of local-orbitals allowed (all core states can be made
valence for example)
* Total energies resolved into components
* LSDA and GGA functionals available
* Isolated molecules or periodic systems
* Core states treated with the radial Dirac equation
.
Elk is parallelized via OpenMP.
