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Items where Person is "Zhu-Tianyu"

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Number of items: 10.

2020

Zhu, Tianyu and Van Voorhis, Troy (2020) Understanding the Dipole Moment of Liquid Water from a Self-Attractive Hartree Decomposition. . (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20201104-131743072

Sun, Qiming and Zhang, Xing and Banerjee, Samragni et al. (2020) Recent developments in the PySCF program package. Journal of Chemical Physics, 153 (2). Art. No. 024109. ISSN 0021-9606. https://resolver.caltech.edu/CaltechAUTHORS:20200710-091035803

Zhu, Tianyu and Chan, Garnet Kin-Lic (2020) All-electron Gaussian-based G₀W₀ for Valence and Core Excitation Energies of Periodic Systems. . (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20200811-091206924

Nakano, Yuji and Black, Michael J. and Meichan, Andrew J. et al. (2020) Photoenzymatic Hydrogenation of Heteroaromatic Olefins using ‘Ene’-Reductases with Photoredox Catalysts. Angewandte Chemie International Edition, 59 (26). pp. 10484-10488. ISSN 1433-7851. https://resolver.caltech.edu/CaltechAUTHORS:20200323-092845496

Zhu, Tianyu and Chan, Garnet Kin-Lic (2020) Ab Initio Full Cell GW+DMFT for Correlated Materials. . (Unpublished) https://resolver.caltech.edu/CaltechAUTHORS:20200420-105853289

Zhu, Tianyu and Cui, Zhi-Hao and Chan, Garnet Kin-Lic (2020) Efficient Formulation of Ab Initio Quantum Embedding in Periodic Systems: Dynamical Mean-Field Theory. Journal of Chemical Theory and Computation, 16 (1). pp. 141-153. ISSN 1549-9618. https://resolver.caltech.edu/CaltechAUTHORS:20191210-142224886

Cui, Zhi-Hao and Zhu, Tianyu and Chan, Garnet Kin-Lic (2020) Efficient Implementation of Ab Initio Quantum Embedding in Periodic Systems: Density Matrix Embedding Theory. Journal of Chemical Theory and Computation, 16 (1). pp. 119-129. ISSN 1549-9618. https://resolver.caltech.edu/CaltechAUTHORS:20191209-135212204

2019

Zhu, Tianyu and Jiménez-Hoyos, Carlos A. and McClain, James et al. (2019) Coupled-cluster impurity solvers for dynamical mean-field theory. Physical Review B, 100 (11). Art. No. 115154. ISSN 2469-9950. https://resolver.caltech.edu/CaltechAUTHORS:20190812-150503966

de Silva, Piotr and Van Voorhis, Troy A. and Zhu, Tianyu (2019) Self-​Attractive Hartree partitioning for density-​based embedding. In: 257th ACS National Meeting & Exposition, 31 March-4 April 2019, Orlando, FL. https://resolver.caltech.edu/CaltechAUTHORS:20190830-090106484

Zhu, Tianyu and de Silva, Piotr and Van Voorhis, Troy (2019) Implementation of the Many-Pair Expansion for Systematically Improving Density Functional Calculations of Molecules. Journal of Chemical Theory and Computation, 15 (2). pp. 1089-1101. ISSN 1549-9618. https://resolver.caltech.edu/CaltechAUTHORS:20190128-154413574

This list was generated on Tue Dec 1 20:16:16 2020 PST.