@article{article, title = {{Quantum computation of electronic structure with projector augmented-wave method and plane wave basis set}}, publisher = {{American Chemical Society (ACS)}}, url = {{https://eprints.whiterose.ac.uk/id/eprint/230538 }}, year = {{2025}}, month = {{8}}, author = {{Ivanov AV and Patterson A and Bothe M and Sünderhauf C and Berntson BK and Mortensen JJ and Kuisma M and Campbell E and Izsák R}}, doi = {{10.1021/acs.jctc.5c00551}}, volume = {{21}}, journal = {{Journal of Chemical Theory and Computation}}, issue = {{15}}, pages = {{7360-7377}}, note = {{Accessed on 2025/11/29}}}