cp2k source package in Groovy

cp2k: Ab Initio Molecular Dynamics
cp2k-data: Ab Initio Molecular Dynamics (data files)
cp2k-dbgsym: debug symbols for cp2k

Versions published

Release

The package versions that were published when the distribution release was made.

cp2k information

Current version:
6.1-3ubuntu2
Uploaded:
2020-03-22
Urgency:
Medium Urgency

Upstream connections

BigDFT1.8

BigDFT is an ab initio code based on Daubechies wavelets. Such functions have features which make them a powerful and promising basis set for application in materials science. These are a compact support multiresolution basis, and form one of the few examples of systematic real space basis sets. They are an optimal basis for expanding localised information. The real space description they provide allows to build an efficient, clean method to treat systems in complex environments, like surfaces geometries or system with a net charge. The mathematical properties of the formalism are optimal to build a robust, highly optimised code, conceived for systems of few hundred atoms, with excellent efficiency on parallel computers

Bug supervisor: yes
Bug tracker: yes
Branch: yes

BigDFT 1.8.3 (Wired) is older than the current packaged version. Launchpad may be missing release information for the 1.8 series or this package is linked to the wrong BigDFT series.

Releases in Ubuntu

Binary packages

Download files from current release (6.1-3ubuntu2)

File Size SHA-256 Checksum
cp2k_6.1.orig.tar.bz2 52.6 MiB af803558e0a6b9e9d9ce8a3ab955ba32bacd179922455424e061c82c9fefa34b
cp2k_6.1-3ubuntu2.debian.tar.xz 14.8 KiB e6e3afd69e60af037e6f179e688358e89712c9e0e3c66885a573b9f747de3798
cp2k_6.1-3ubuntu2.dsc 2.2 KiB 3047ea8932f5fc03386c383ce1a0869282619910a343c93331c9459b7b436d66

Package relationships

Build dependencies

Platform-independent build dependencies

Platform-dependent build dependencies

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Platform-independent build dependencies

Platform-dependent build dependencies