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Persistent URL	http://purl.org/net/epubs/work/56879950
Record Status	Checked
Record Id	56879950
Title	Toward Accurate Post-Born–Oppenheimer Molecular Simulations on Quantum Computers: An Adaptive Variational Eigensolver with Nuclear-Electronic Frozen Natural Orbitals
Contributors	A Nykänen, A Miller, W Talarico, S Knecht, A Kovyrshin, M Skogh, L Tornberg, A Broo, S Mensa (STFC Daresbury Lab.), BCB Symons (STFC Daresbury Lab.), E Sahin (STFC Daresbury Lab.), J Crain, I Tavernelli, F Pavošević
Abstract
Organisation	STFC , HC
Keywords
Funding Information	SNSF (205602); Wallenberg Center for Quantum Technology, Chalmers University of Technology
Related Research Object(s):
Licence Information:
Language	English (EN)

Type	Details	URI(s)	Local file(s)	Year
Journal Article	J Chem Theory Comput 19, no. 24 (2023): 9269-9277.	doi:10.1021/acs.jctc.3c01091		2023