山东大学教师主页郭阳论文成果中文主页

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个人信息

郭阳Yang Guo

(教授)

博士生导师硕士生导师
教师姓名：郭阳
教师英文名称：Yang Guo
入职时间：2019-08
所在单位：化学与化工学院
学历：博士研究生毕业
性别：男
学位：博士生
职称：教授
毕业院校：南京大学

论文成果

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[1] 闫伯涵. Sublinear scaling method for indirect spin–spin coupling constant calculations at Hartree–Fock and density functional theory level. THE JOURNAL OF CH..., 2025.
[2] 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 Chemic..., 162, 2025.
[3] 郭阳. SOiCISCF: Combining SOiCI and iCISCF for Variational Treatment of Spin-Orbit Coupling. Journal of chemic..., 19, 2023.
[4] 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 ..., 158, 2023.
[5] Wang, Yuqi. Cluster-in-Molecule Approach with Explicitly Correlated Methods for Large Molecules. Journal of chemic..., 2023.
[6] 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 chemic..., 18, 6510-6521, 2022.
[7] Chen, Yating. Stacking-dependent tetracolour luminescence and mechanofluorochromic properties of an isoquinoline derivative with aggregation-induced emission. MATERIALS CHEMIST..., 6, 459, 2022.
[8] Kollmar, Christian. An efficient implementation of the NEVPT2 and CASPT2 methods avoiding higher-order density matrices. Journal of Chemic..., 155, 2021.
[9] 宋阳阳. The Static-Dynamic-Static Family of Methods for Strongly Correlated Electrons: Methodology and Benchmarking. TOPICS IN CURRENT..., 379, 2021.
[10] 郭阳. iCISCF: An Iterative Configuration Interaction-Based Multiconfigurational Self-Consistent Field Theory for Large Active Spaces.. Journal of chemic..., 17, 7545-7561, 2021.
[11] 郭阳. Approximations of density matrices in N-electron valence state second-order perturbation theory (NEVPT2). I. Revisiting the NEVPT2 construction. Journal of Chemic..., 154, 2021.
[12] 郭阳. Approximations of density matrices in N-electron valence state second-order perturbation theory (NEVPT2). II. The full rank NEVPT2 (FR-NEVPT2) formulation. Journal of Chemic..., 154, 2021.
[13] Ni, Zhigang. Cluster-in-Molecule Local Correlation Method with an Accurate Distant Pair Correction for Large Systems. Journal of chemic..., 17, 756, 2021.
[14] 张勇. BDF: A relativistic electronic structure program package. Journal of Chemic..., 152, 2020.

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