CITATION

                     CITATION FOR LIBECPINT

If you use this library in your program and find it helpful, that's great! Any feedback would be much appreciated. If you publish results using this library, please consider citing the following paper detailing the implementation:

R. A. Shaw, J. G. Hill, J. Chem. Phys. 147, 074108 (2017)

The literature citation in bibtex format is:

@article{Shaw2017,
author = {Shaw, Robert A. and Hill, J. Grant},
doi = {10.1063/1.4986887},
issn = {0021-9606},
journal = {The Journal of Chemical Physics},
month = {aug},
number = {7},
pages = {074108},
title = {{Prescreening and efficiency in the evaluation of integrals over ab initio effective core potentials}},
url = {http://aip.scitation.org/doi/10.1063/1.4986887},
volume = {147},
year = {2017}
}

The following JOSS paper formally presents the library:

R. A. Shaw, J. G. Hill, J. Open Source Softw. 6, 3039 (2021)

@article{Shaw2021, 
author = {Robert A. Shaw and J. Grant Hill}, 
doi = {10.21105/joss.03039},
journal = {Journal of Open Source Software},
publisher = {The Open Journal}, 
number = {60}, 
pages = {3039},
title = {libecpint: A C++ library for the efficient evaluation of integrals over effective core potentials}, 
url = {https://doi.org/10.21105/joss.03039}, 
volume = {6}, 
year = {2021}
}

Please also remember to include citations for the methods, basis sets and ECPs you use!