[Debichem-devel] Accepted chemps2 1.8.7-1 (source amd64 all) into unstable, unstable
Sebastian Wouters
sebastianwouters at gmail.com
Tue Mar 27 10:00:10 UTC 2018
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Hash: SHA512
Format: 1.8
Date: Sun, 25 Mar 2018 22:09:14 +0200
Source: chemps2
Binary: libchemps2-3 libchemps2-dev chemps2-doc chemps2 python3-chemps2
Architecture: source amd64 all
Version: 1.8.7-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-devel at lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwouters at gmail.com>
Description:
chemps2 - Executable to call libchemps2-3 from the command line
chemps2-doc - Documentation of the libchemps2-3 package
libchemps2-3 - Spin-adapted DMRG for ab initio quantum chemistry
libchemps2-dev - C++ headers, static library, and symlink for libchemps2-3
python3-chemps2 - Python 3 interface for libchemps2-3
Changes:
chemps2 (1.8.7-1) unstable; urgency=medium
.
* Upstream 1.8.6: Set initial guess to ROHF determinant
* Added optional arguments to DMRG::DMRG and
DMRG::setupBookkeeperAndMPS
* Upstream 1.8.7: Bump up SO version
* libchemps2-2 becomes libchemps2-3
Checksums-Sha1:
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Files:
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