Graphic Characterization and Clustering Configuration Descriptors of Determinant Space for Molecules-Reference-Cited by-同舟云学术

Graphic Characterization and Clustering Configuration Descriptors of Determinant Space for Molecules

Published:2023-04-04 Issue:8 Volume:19 Page:2282-2290
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Sun Lei¹,Zhang Zixi¹,Jiang Tonghuan¹,Chen Yilin²,Chen Ji¹³⁴⁵^ORCID

Affiliation:

1. School of Physics, Peking University, Beijing 100871, P. R. China

2. International Center for Quantum Materials, School of Physics, Peking University, Beijing 100871, P. R. China

3. Collaborative Innovation Center of Quantum Matter, Beijing 100871, P. R. China

4. Interdisciplinary Institute of Light-Element Quantum Materials and Research Center for Light-Element Advanced Materials, Peking University, Beijing 100871, P. R. China

5. Frontiers Science Center for Nano-Optoelectronics, Peking University, Beijing 100871, P. R. China

Funder

Ministry of Science and Technology of the People's Republic of China

National Natural Science Foundation of China

Chinese Academy of 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.3c00076

Reference41 articles.

1. Nobel Lecture: Quantum chemical models

2. Nobel Lecture: Electronic structure of matter—wave functions and density functionals

3. Iterative perturbation calculations of ground and excited state energies from multiconfigurational zeroth‐order wavefunctions

4. Identification of deadwood in configuration spaces through general direct configuration interaction

5. Compressive sampling in configuration interaction wavefunctions

Cited by 1 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. Multiconfigurational nature of electron correlation within nitrogen vacancy centers in diamond;Physical Review B;2023-07-10