Version: 1.0.0
Release date: 29 September 2020
This is the first stable release of the libecpint library, superseding the beta versions (0.9.0 through 0.9.3).
Features
- autogenerated radial integration code
- improved screening over shell blocks and shell triples
- analytical first and second derivatives
- high-level API with ECP library
- over 10x faster than initial versions
- greatly expanded tests/examples, including unit tests through GoogleTest
- streamlined build system
- automated testing/continuous integration
- better documentation, using Sphinx