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Paper Publications

[1] Wang, Yuqi. Cluster-in-Molecule Method Combined with the Domain-Based Local Pair Natural Orbital Approach for.... Journal of chemical theory and computation, 18, 6510-6521, 2022.
[2] Wang, Yuqi. Cluster-in-Molecule Approach with Explicitly Correlated Methods for Large Molecules. Journal of chemical theory and computation, 2023.
[3] 郭阳. SparseMaps - A systematic infrastructure for reduced-scaling electronic structure methods. VI. Li.... journal physical chemistry, 158, 2023.
[4] Kollmar, Christian. An efficient implementation of the NEVPT2 and CASPT2 methods avoiding higher-order density matric.... Journal of Chemical Physics, 155, 2021.
[5] Chen, Yating. Stacking-dependent tetracolour luminescence and mechanofluorochromic properties of an isoquinolin.... MATERIALS CHEMISTRY FRONTIERS, 6, 459, 2022.
[6] 郭阳. SOiCISCF: Combining SOiCI and iCISCF for Variational Treatment of Spin-Orbit Coupling. Journal of chemical theory and computation, 19, 2023.
[7] 郭阳. iCISCF: An Iterative Configuration Interaction-Based Multiconfigurational Self-Consistent Field T.... Journal of chemical theory and computation, 17, 7545-7561, 2021.
[8] 郭阳. iCISCF: An Iterative Configuration Interaction-Based Multiconfigurational Self-Consistent Field T.... Journal of chemical theory and computation, 2021.
[9] Ni, Zhigang. Cluster-in-Molecule Local Correlation Method with an Accurate Distant Pair Correction for Large S.... Journal of chemical theory and computation, 17, 756, 2021.
[10] 宋阳阳. The Static-Dynamic-Static Family of Methods for Strongly Correlated Electrons: Methodology and Be.... TOPICS IN CURRENT CHEMISTRY, 379, 2021.

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