https://github.com/orbkit/orbkit
Name Target Message Date
HEAD dcfcc20 Update setup.py Added missing requirement scikit-image 24 July 2021, 07:47:20 UTC
refs/heads/41-vp/missing-sym 623b080 BUG: Support for molden files missing Sym= key 22 July 2021, 20:14:05 UTC
refs/heads/MO_order b5c9276 call update() in sort_by_energy() 25 January 2018, 14:02:21 UTC
refs/heads/charge_transfer e584a3c ENH: Minor changes in qcinfo, gaussian_log, and density_matrix 26 October 2018, 14:54:58 UTC
refs/heads/cython ef99cb7 Merge pull request #25 from mcrav/cython Fixed bug with view_with_mayavi outdated map call 19 August 2019, 19:09:33 UTC
refs/heads/dependabot/add-v2-config-file bfa987c Upgrade to GitHub-native Dependabot 28 April 2021, 22:09:54 UTC
refs/heads/development a9f1e29 Merge pull request #27 from orbkit/vp/cbobs-bug BUG: Fixed minor python3 compatibility issues 22 August 2019, 19:35:04 UTC
refs/heads/dynkit c786bee First steps in Dynkit - Very much a fist try - maybe this can provide a base structure for how Dynkit can be implemented. 04 September 2017, 12:30:04 UTC
refs/heads/gh/orbitals_to_surface 313a929 BUG: Fixed wrong spelling. 10 March 2021, 11:56:50 UTC
refs/heads/gzip 79044f0 ENH: add support for gzipped files 23 February 2021, 12:55:08 UTC
refs/heads/jj-gpaw 53d8175 ENH: Change year in README 20 December 2019, 14:15:00 UTC
refs/heads/master dcfcc20 Update setup.py Added missing requirement scikit-image 24 July 2021, 07:47:20 UTC
refs/heads/molden_writer 07db4b3 Add test for molden writer 21 December 2017, 14:28:45 UTC
refs/heads/pbc a3c4554 WIP: PBC in Orbkit - More work on tools for use in periodic Orbkit 27 November 2017, 12:35:29 UTC
refs/heads/population_analysis e267997 replace some futher for-loops with numpy calls 12 January 2018, 16:01:33 UTC
refs/heads/reduced_density ddeaedf WIP cy_core using reduced density matrix (Tij) - Initial work on using Tij to compute things in cy_core. 04 September 2017, 13:41:14 UTC
refs/heads/so_coupling e266a05 von Neumann entropy - DM instances can now calculate non Neumann entropy 28 August 2017, 12:21:40 UTC
refs/heads/vp/install c58ca51 BUG: Fixed trailing whitespace 06 March 2020, 14:42:46 UTC
refs/tags/v0.5 f7c91ee Resolved Python 3 issue - ``long`` type integer are no longer available in Python 3 11 May 2016, 10:33:10 UTC
refs/tags/v1.0 cd7568a DOC: changed version number to v1.0 04 September 2017, 15:23:19 UTC
back to top