Format: 1.8
Date: Sun, 30 Oct 2022 16:44:54 +0100
Source: cp2k
Binary: cp2k
Built-For-Profiles: noudeb
Architecture: riscv64
Version: 2022.2-1
Distribution: lunar-proposed
Urgency: medium
Maintainer: Launchpad Build Daemon <buildd@riscv64-qemu-lgw01-015.buildd>
Changed-By: Michael Banck <mbanck@debian.org>
Description:
 cp2k       - Ab Initio Molecular Dynamics
Changes:
 cp2k (2022.2-1) unstable; urgency=medium
 .
   * New upstream release, new features include:
     + HIP support for PW
     + K-points for the GW self-energy
     + GAPW Voronoi integration
     + Improve support for metaGGA functionals
     + State following using transition charge finger print in TDDFT
     + Barostat for frozen atoms in absolute coordinate
     + Low-scaling SOS-Laplace MP2 forces
     + RPA low-scaling gradients
     + CDFT forces based on Hirshfeld partitioning
     + GW 4-center Hartree-Fock and ADMM for exchange self-energy
     + Partially occupied Wannier states
     + GAPW_XC for TDDFPT energies
     + LibXC equivalents to ADMM exchange potentials
     + Print vibrational modes for Newton-X
     + Migrate tensor operations to new sparse matrix library DBM
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Files:
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