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Journal of Chemical Theory and Computation
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August 1, 2019
Performance of Delta-Coupled-Cluster Methods for Calculations of Core-Ionization Energies of First-Row Elements
Xuechen Zheng, Lan Cheng
The Journal of Chemical Physics
|
April 23, 2022
Geometry optimizations with spinor-based relativistic coupled-cluster theory
Xuechen Zheng, Chaoqun Zhang, Junzi Liu, et al.
The Journal of Physical Chemistry. A
|
April 8, 2020
Hetero-site Double Core Ionization Energies with Sub-electronvolt Accuracy from Delta-Coupled-Cluster Calculations
Xuechen Zheng, Junzi Liu, Gilles Doumy, et al.
The Journal of Chemical Physics
|
February 16, 2021
Analytic evaluation of energy first derivatives for spin-orbit coupled-cluster singles and doubles augmented with noniterative triples method: General formulation and an implementation for first-order properties
Junzi Liu, Xuechen Zheng, Ayush Asthana, et al.
The Journal of Chemical Physics
|
December 28, 2023
Analytic gradients for relativistic exact-two-component equation-of-motion coupled-cluster singles and doubles method
Chaoqun Zhang, Xuechen Zheng, Junzi Liu, et al.
The Journal of Physical Chemistry. A
|
September 23, 2024
Elucidating Anomalous Intensity Ratios in Chlorine L-Edge X-ray Absorption Spectroscopy: Multiplet Effects and Core Rydberg Transitions
Zhe Lin, Junzi Liu, Chaoqun Zhang, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 26, 2022
Benchmark relativistic delta-coupled-cluster calculations of K-edge core-ionization energies of third-row elements
Xuechen Zheng, Chaoqun Zhang, Zheqi Jin, et al.
The Journal of Chemical Physics
|
April 8, 2023
X-ray induced electron and ion fragmentation dynamics in IBr
Phay J Ho, Dipanwita Ray, C Stefan Lehmann, et al.
Innovation (Cambridge (Mass.))
|
March 6, 2026
The faintest, extremely variable X-ray tidal disruption event from a supermassive black hole binary?
Mengqiu Huang, Yongquan Xue, Shuo Li, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 9) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
August 1, 2019
Performance of Delta-Coupled-Cluster Methods for Calculations of Core-Ionization Energies of First-Row Elements
Xuechen Zheng, Lan Cheng
The Journal of Chemical Physics
|
April 23, 2022
Geometry optimizations with spinor-based relativistic coupled-cluster theory
Xuechen Zheng, Chaoqun Zhang, Junzi Liu, et al.
The Journal of Physical Chemistry. A
|
April 8, 2020
Hetero-site Double Core Ionization Energies with Sub-electronvolt Accuracy from Delta-Coupled-Cluster Calculations
Xuechen Zheng, Junzi Liu, Gilles Doumy, et al.
The Journal of Chemical Physics
|
February 16, 2021
Analytic evaluation of energy first derivatives for spin-orbit coupled-cluster singles and doubles augmented with noniterative triples method: General formulation and an implementation for first-order properties
Junzi Liu, Xuechen Zheng, Ayush Asthana, et al.
The Journal of Chemical Physics
|
December 28, 2023
Analytic gradients for relativistic exact-two-component equation-of-motion coupled-cluster singles and doubles method
Chaoqun Zhang, Xuechen Zheng, Junzi Liu, et al.
The Journal of Physical Chemistry. A
|
September 23, 2024
Elucidating Anomalous Intensity Ratios in Chlorine L-Edge X-ray Absorption Spectroscopy: Multiplet Effects and Core Rydberg Transitions
Zhe Lin, Junzi Liu, Chaoqun Zhang, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 26, 2022
Benchmark relativistic delta-coupled-cluster calculations of K-edge core-ionization energies of third-row elements
Xuechen Zheng, Chaoqun Zhang, Zheqi Jin, et al.
The Journal of Chemical Physics
|
April 8, 2023
X-ray induced electron and ion fragmentation dynamics in IBr
Phay J Ho, Dipanwita Ray, C Stefan Lehmann, et al.
Innovation (Cambridge (Mass.))
|
March 6, 2026
The faintest, extremely variable X-ray tidal disruption event from a supermassive black hole binary?
Mengqiu Huang, Yongquan Xue, Shuo Li, et al.
Page
of 1