Software Open Access
UK R-matrix community
Outer region programs for the reengineered UK computational implementation of the R-matrix method for the treatment of electron and positron scattering from molecules (BTO/GTO continuum). Also calculates photoionization cross sections.
This version corrects 3 bugs in the program dipelm:
For a complete list of the authors who contributed to this software see https://www.ukamor.com/ and a file in the release tarball (after release 3.0).
Features of release 3.0:
This version uses GBTOlib 2.0.
Name | Size | |
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ukrmol-out-3.0.2.tar.gz
md5:ee559cfdba01946ef13a9265ab5181d7 |
2.4 MB | Download |
All versions | This version | |
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Views | 686 | 100 |
Downloads | 223 | 33 |
Data volume | 447.2 MB | 80.7 MB |
Unique views | 481 | 81 |
Unique downloads | 174 | 33 |