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First- and quasi-second-order optimization algorithms in variational Monte Carlo

Ruojing Peng1,* and Garnet Kin-Lic Chan1,2,†

  • *Contact author: rpeng@fas.harvard.edu
  • †Contact author: gkc1000@gmail.com

Large-scale first-principles electronic structure methods

Weiqing Zhou, Zhichang Fu, and Shengjun Yuan

Chem. Soc. Rev. 55 11494 (2026)

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