TY  - JOUR

T1  - Quantum computation of electronic structure with projector augmented-wave method and plane wave basis set

JO  - Journal of Chemical Theory and Computation

UR  - https://eprints.whiterose.ac.uk/id/eprint/230538

PY  - 2025/08/04

AU  - Ivanov AV

AU  - Patterson A

AU  - Bothe M

AU  - Sünderhauf C

AU  - Berntson BK

AU  - Mortensen JJ

AU  - Kuisma M

AU  - Campbell E

AU  - Izsák R

ED  - 

DO  - DOI: 10.1021/acs.jctc.5c00551

PB  - American Chemical Society (ACS)

VL  - 21

IS  - 15

SP  - 7360

EP  - 7377

Y2  - 2025/11/29

ER  -