Optimization Stability in Excited-State-Specific Variational Monte Carlo-Reference-Cited by-同舟云学术

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Optimization Stability in Excited-State-Specific Variational Monte Carlo

Published:2023-01-20 Issue:3 Volume:19 Page:767-782
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Otis Leon¹^ORCID,Neuscamman Eric²³^ORCID

Affiliation:

1. Department of Physics, University of California Berkeley, Berkeley, California 94720, United States

2. Department of Chemistry, University of California Berkeley, Berkeley, California 94720, United States

3. Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States

Funder

Basic Energy Sciences

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.2c00642

Reference70 articles.

1. Optimization of Ground- and Excited-State Wave Functions and van der Waals Clusters

2. Projector Quantum Monte Carlo Method for Nonlinear Wave Functions

3. Improved Speed and Scaling in Orbital Space Variational Monte Carlo

4. Backflow Transformations via Neural Networks for Quantum Many-Body Wave Functions

5. Symmetry-Projected Jastrow Mean-Field Wave Function in Variational Monte Carlo

Cited by 4 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Ensemble variational Monte Carlo for optimization of correlated excited state wave functions;Electronic Structure;2024-04-08

2. Variational Quantum Monte Carlo Solution of the Many-Electron Schrödinger Equation Based on Deep Neural Networks;CAAI Artificial Intelligence Research;2024-02

3. Partial Separability of the Schrödinger Equation Combined with a Jastrow Factor;Journal of Chemical Theory and Computation;2023-11-15

4. Calculating many excited states of the multidimensional time-independent Schrödinger equation using a neural network;Physical Review A;2023-09-05

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