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X
Feng, Xintian
138  Ergebnisse:
Personensuche X
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1

Analytic Evaluation of Nonadiabatic Couplings within the Co..:

Chatterjee, Koushik ; Koczor-Benda, Zsuzsanna ; Feng, Xintian..
Journal of Chemical Theory and Computation.  , 2023
Link: https://doi.org/10.1021/..
 
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2

Analytical harmonic vibrational frequencies with VV10-conta..:

Liang, Jiashu ; Feng, Xintian ; Liu, Xiao.
The Journal of Chemical Physics.  158 (2023)  20 - p. , 2023
Link: https://doi.org/10.1063/..
 
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3

Revisiting the Performance of Time-Dependent Density Functi..:

Liang, Jiashu ; Feng, Xintian ; Hait, Diptarka.
Journal of Chemical Theory and Computation.  18 (2022)  6 - p. 3460-3473 , 2022
Link: https://doi.org/10.1021/..
 
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4

Faster Exact Exchange for Solids via occ-RI-K: Application ..:

Lee, Joonho ; Rettig, Adam ; Feng, Xintian..
Journal of Chemical Theory and Computation.  18 (2022)  12 - p. 7336-7349 , 2022
Link: https://doi.org/10.1021/..
 
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5

Approaching the basis set limit in Gaussian-orbital-based p..:

Lee, Joonho ; Feng, Xintian ; Cunha, Leonardo A....
The Journal of Chemical Physics.  155 (2021)  16 - p. , 2021
Link: https://doi.org/10.1063/..
 
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6

Transition states, reaction paths, and thermochemistry usin..:

Schneider, Patrick E. ; Tao, Zhen ; Pavošević, Fabijan...
The Journal of Chemical Physics.  154 (2021)  5 - p. , 2021
Link: https://doi.org/10.1063/..
 
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7

Software for the frontiers of quantum chemistry: An overvie..:

Epifanovsky, Evgeny ; Gilbert, Andrew T. B. ; Feng, Xintian...
The Journal of Chemical Physics.  155 (2021)  8 - p. , 2021
Link: https://doi.org/10.1063/..
 
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8

New and Efficient Equation-of-Motion Coupled-Cluster Framew..:

Vidal, Marta L. ; Feng, Xintian ; Epifanovsky, Evgeny..
Journal of Chemical Theory and Computation.  15 (2019)  5 - p. 3117-3133 , 2019
Link: https://doi.org/10.1021/..
 
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9

Implementation of analytic gradients for CCSD and EOM-CCSD ..:

Feng, Xintian ; Epifanovsky, Evgeny ; Gauss, Jürgen.
The Journal of Chemical Physics.  151 (2019)  1 - p. , 2019
Link: https://doi.org/10.1063/..
 
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10

Linker-Dependent Singlet Fission in Tetracene Dimers:

Korovina, Nadezhda V. ; Joy, Jimmy ; Feng, Xintian...
Journal of the American Chemical Society.  140 (2018)  32 - p. 10179-10190 , 2018
Link: https://doi.org/10.1021/..
 
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11

Singlet Fission in a Covalently Linked Cofacial Alkynyltetr..:

Korovina, Nadezhda V. ; Das, Saptaparna ; Nett, Zachary...
Journal of the American Chemical Society.  138 (2016)  2 - p. 617-627 , 2016
Link: https://doi.org/10.1021/..
 
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12

On couplings and excimers: lessons from studies of singlet ..:

Feng, Xintian ; Krylov, Anna I.
Physical Chemistry Chemical Physics.  18 (2016)  11 - p. 7751-7761 , 2016
Link: https://doi.org/10.1039/..
 
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13

Intra- and Intermolecular Singlet Fission in Covalently Lin..:

Feng, Xintian ; Casanova, David ; Krylov, Anna I.
The Journal of Physical Chemistry C.  120 (2016)  34 - p. 19070-19077 , 2016
Link: https://doi.org/10.1021/..
 
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14

Quantifying charge resonance and multiexciton character in ..:

Luzanov, Anatoliy V. ; Casanova, David ; Feng, Xintian.
The Journal of Chemical Physics.  142 (2015)  22 - p. , 2015
Link: https://doi.org/10.1063/..
 
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15

Advances in molecular quantum chemistry contained in the Q-..:

Shao, Yihan ; Gan, Zhengting ; Epifanovsky, Evgeny...
Molecular Physics.  113 (2014)  2 - p. 184-215 , 2014
Link: https://doi.org/10.1080/..
 
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