Personal Information
Professor Supervisor of Doctorate Candidates Supervisor of Master's Candidates
Scientific Research
Working-Papers
No Content
Paper Publications
More>>
- 闫伯涵. Sublinear scaling method for indirect spin–spin coupling constant calculations at Hartree–Fock and density functional theory level. THE JOURNAL OF CHEMICAL PHYSICS, 2025.
- 郭阳. Approximations of density matrices in N-electron valence state second-order perturbation theory (NEVPT2). III. Large active space calculations with selected configuration interaction reference. Journal of Chemical Physics, 162, 2025.
- 郭阳. SOiCISCF: Combining SOiCI and iCISCF for Variational Treatment of Spin-Orbit Coupling. Journal of chemical theory and computation, 19, 2024.
- 郭阳. SparseMaps - A systematic infrastructure for reduced-scaling electronic structure methods. VI. Linear-scaling explicitly correlated N-electron valence state perturbation theory with pair natural orbital. journal physical chemistry, 158, 2024.
- Wang, Yuqi. Cluster-in-Molecule Approach with Explicitly Correlated Methods for Large Molecules. Journal of chemical theory and computation, 2024.
- Wang, Yuqi. Cluster-in-Molecule Method Combined with the Domain-Based Local Pair Natural Orbital Approach for Electron Correlation Calculations of Periodic Systems.. Journal of chemical theory and computation, 18, 6510-6521, 2024.
Patents
- No Content
Published Books
- No Content
Research Projects
More>>
Research Team
- No Content