Year |
Citation |
Score |
2024 |
Li C, Mao S, Huang R, Evangelista FA. Frozen Natural Orbitals for the State-Averaged Driven Similarity Renormalization Group. Journal of Chemical Theory and Computation. PMID 38747709 DOI: 10.1021/acs.jctc.4c00152 |
0.419 |
|
2022 |
Wang M, Fang WH, Li C. Assessment of State-Averaged Driven Similarity Renormalization Group on Vertical Excitation Energies: Optimal Flow Parameters and Applications to Nucleobases. Journal of Chemical Theory and Computation. 19: 122-136. PMID 36534617 DOI: 10.1021/acs.jctc.2c00966 |
0.325 |
|
2022 |
He N, Li C, Evangelista FA. Second-Order Active-Space Embedding Theory. Journal of Chemical Theory and Computation. PMID 35175028 DOI: 10.1021/acs.jctc.1c01099 |
0.714 |
|
2021 |
Huang M, Li C, Evangelista FA. Theoretical Calculation of Core-Excited States along Dissociative Pathways beyond Second-Order Perturbation Theory. Journal of Chemical Theory and Computation. PMID 34964628 DOI: 10.1021/acs.jctc.1c00884 |
0.741 |
|
2021 |
Wang S, Li C, Evangelista FA. Analytic Energy Gradients for the Driven Similarity Renormalization Group Multireference Second-Order Perturbation Theory. Journal of Chemical Theory and Computation. 17: 7666-7681. PMID 34839660 DOI: 10.1021/acs.jctc.1c00980 |
0.753 |
|
2021 |
Li C, Evangelista FA. Spin-free formulation of the multireference driven similarity renormalization group: A benchmark study of first-row diatomic molecules and spin-crossover energetics. The Journal of Chemical Physics. 155: 114111. PMID 34551530 DOI: 10.1063/5.0059362 |
0.708 |
|
2020 |
Xu Z, Huang Z, Li C, Huang T, Evangelista FA, Tang ML, Lian T. Tuning QD/mediator Interface for Optimal Efficiency of Quantum Dot Sensitized Near Infrared to Visible Photon Upconversion Systems. Acs Applied Materials & Interfaces. PMID 32677433 DOI: 10.1021/Acsami.0C10269 |
0.65 |
|
2020 |
Li C, Evangelista FA. Connected three-body terms in single-reference unitary many-body theories: Iterative and perturbative approximations. The Journal of Chemical Physics. 152: 234116. PMID 32571040 DOI: 10.1063/5.0008353 |
0.737 |
|
2019 |
Wang S, Li C, Evangelista FA. Analytic gradients for the single-reference driven similarity renormalization group second-order perturbation theory. The Journal of Chemical Physics. 151: 044118. PMID 31370522 DOI: 10.1063/1.5100175 |
0.747 |
|
2019 |
Zhang T, Li C, Evangelista FA. Improving the efficiency of the multireference driven similarity renormalization group via sequential transformation, density fitting, and the non-interacting virtual orbital approximation. Journal of Chemical Theory and Computation. PMID 31268704 DOI: 10.1021/acs.jctc.9b00353 |
0.732 |
|
2019 |
Li C, Lindh R, Evangelista FA. Dynamically weighted multireference perturbation theory: Combining the advantages of multi-state and state-averaged methods. The Journal of Chemical Physics. 150: 144107. PMID 30981256 DOI: 10.1063/1.5088120 |
0.708 |
|
2019 |
Li C, Evangelista FA. Multireference Theories of Electron Correlation Based on the Driven Similarity Renormalization Group. Annual Review of Physical Chemistry. PMID 30893000 DOI: 10.1146/annurev-physchem-042018-052416 |
0.679 |
|
2018 |
Schriber JB, Hannon KP, Li C, Evangelista FA. A Combined Selected Configuration Interaction and Many-Body Treatment of Static and Dynamical Correlation in Oligoacenes. Journal of Chemical Theory and Computation. PMID 30388005 DOI: 10.1021/acs.jctc.8b00877 |
0.692 |
|
2018 |
Li C, Evangelista FA. Driven similarity renormalization group for excited states: A state-averaged perturbation theory. The Journal of Chemical Physics. 148: 124106. PMID 29604867 DOI: 10.1063/1.5019793 |
0.74 |
|
2018 |
Li C, Evangelista FA. Erratum: "Driven similarity renormalization group: Third-order multireference perturbation theory" [J. Chem. Phys. 146, 124132 (2017)]. The Journal of Chemical Physics. 148: 079902. PMID 29471654 DOI: 10.1063/1.5023904 |
0.73 |
|
2018 |
Li C, Evangelista FA. Erratum: "Towards numerically robust multireference theories: The driven similarity renormalization group truncated to one- and two-body operators" [J. Chem. Phys. 144, 164114 (2016)]. The Journal of Chemical Physics. 148: 079903. PMID 29471648 DOI: 10.1063/1.5023493 |
0.711 |
|
2017 |
Li C, Verma P, Hannon KP, Evangelista FA. A low-cost approach to electronic excitation energies based on the driven similarity renormalization group. The Journal of Chemical Physics. 147: 074107. PMID 28830152 DOI: 10.1063/1.4997480 |
0.715 |
|
2017 |
Li C, Evangelista FA. Driven similarity renormalization group: Third-order multireference perturbation theory. The Journal of Chemical Physics. 146: 124132. PMID 28388133 DOI: 10.1063/1.4979016 |
0.74 |
|
2016 |
Hannon KP, Li C, Evangelista FA. An integral-factorized implementation of the driven similarity renormalization group second-order multireference perturbation theory. The Journal of Chemical Physics. 144: 204111. PMID 27250283 DOI: 10.1063/1.4951684 |
0.747 |
|
2016 |
Li C, Evangelista FA. Towards numerically robust multireference theories: The driven similarity renormalization group truncated to one- and two-body operators. The Journal of Chemical Physics. 144: 164114. PMID 27131538 DOI: 10.1063/1.4947218 |
0.742 |
|
2015 |
Li C, Evangelista FA. Multireference Driven Similarity Renormalization Group: A Second-Order Perturbative Analysis. Journal of Chemical Theory and Computation. 11: 2097-108. PMID 26574413 DOI: 10.1021/acs.jctc.5b00134 |
0.745 |
|
2015 |
Li C, Agarwal J, Wu CH, Allen WD, Schaefer HF. Intricate internal rotation surface and fundamental infrared transitions of the n-propyl radical. The Journal of Physical Chemistry. B. 119: 728-35. PMID 25007004 DOI: 10.1021/Jp504764T |
0.628 |
|
2015 |
Li C, Agarwal J, Wu CH, Allen WD, Schaefer HF. Intricate internal rotation surface and fundamental infrared transitions of the n-propyl radical. The Journal of Physical Chemistry. B. 119: 728-35. PMID 25007004 DOI: 10.1021/Jp504764T |
0.628 |
|
2014 |
Li C, Agarwal J, Schaefer HF. The remarkable [ReH9]2- dianion: molecular structure and vibrational frequencies. The Journal of Physical Chemistry. B. 118: 6482-90. PMID 24494734 DOI: 10.1021/jp412003s |
0.429 |
|
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