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physics.chem-ph2024★ 17 cited
Improved Optimization for the Neural-network Quantum States and Tests on the Chromium Dimer
Xiang Li, Jia-Cheng Huang, Guang-Ze Zhang +5
The advent of Neural-network Quantum States (NQS) has significantly advanced wave function ansatz research, sparking a resurgence in orbital space variational Monte Carlo (VMC) exp…
physics.chem-ph2023★ 15 cited
A Non-stochastic Optimization Algorithm for Neural-network Quantum States
Xiang Li, Jia-Cheng Huang, Guang-Ze Zhang +4
Neural-network quantum states (NQS) employ artificial neural networks to encode many-body wave functions in second quantization through variational Monte Carlo (VMC). They have rec…