Planted Solutions in Quantum Chemistry: Generating Non-Trivial Hamiltonians with Known Ground States

Generating large, nontrivial quantum chemistry test problems with known ground-state solutions remains a core challenge for benchmarking electronic structure methods. Inspired by planted-solution techniques from combinatorial optimization, we introduce four classes of Hamiltonians with embedded, ret...

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Bibliographic Details

Published in:	Journal of chemical theory and computation Vol. 21; no. 22; p. 11495
Main Authors:	Wang, Linjun, Cantin, Joshua T, Patel, Smik, Loaiza, Ignacio, Huang, Rick, Izmaylov, Artur F
Format:	Journal Article
Language:	English
Published:	United States 25.11.2025
ISSN:	1549-9626, 1549-9626
Online Access:	Get more information
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