Work

Spin-Density Functional Regularization for Singlet Diradicals

Year: 2025

Type: article

Source: Journal of Chemical Theory and Computation

DOI: 10.1021/acs.jctc.5c00942

Authors: Yi Shi, Yuming Shi, Adam Wasserman, Xin-Zheng Li

Institutions: Peking University, State Key Laboratory of Artificial Microstructure and Mesoscopic Physics, Stanford University, Purdue University West Lafayette, Collaborative Innovation Center of Quantum Matter

Language: English

Topic: Advanced Chemical Physics Studies

Subfield: Atomic and Molecular Physics, and Optics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: closed

Funders: National Natural Science Foundation of China, National Key Research and Development Program of China, Division of Chemistry

Awards: G1399844993, G1815335164, G3557817796, G443658672, G4451133272, G5080220451, G5931473076

OpenAlex ID: W4413424944

FWCI: 0.374

Cites: 75

Cited by: 1

Related to: 10