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Zikuan Wang

Showing results (1-10 of 39) with videos related to

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The Journal of Chemical Physics|May 8, 2023
Development of NOTCH, an all-electron, beyond-NDDO semiempirical method: Application to diatomic moleculesZikuan Wang, Frank Neese
Journal of Chemical Theory and Computation|July 9, 2021
iOI: An Iterative Orbital Interaction Approach for Solving the Self-Consistent Field ProblemZikuan Wang, Wenjian Liu
Dalton Transactions (Cambridge, England : 2003)|August 3, 2016
Light induced catalytic intramolecular hydrofunctionalization of allylphenols mediated by porphyrin rhodium(iii) complexesXu Liu, Zikuan Wang, Xuefeng Fu
Journal of Chemical Theory and Computation|October 4, 2024
Efficient and Robust Ab Initio Self-Consistent Field Acceleration Algorithm Based on a Semiempirical Model HamiltonianLangyuan Qin, Zikuan Wang, Bingbing Suo
Accounts of Chemical Research|August 27, 2021
NAC-TDDFT: Time-Dependent Density Functional Theory for Nonadiabatic CouplingsZikuan Wang, Chenyu Wu, Wenjian Liu
Chemical Communications (Cambridge, England)|June 27, 2015
Visible light promoted hydration of alkynes catalyzed by rhodium(III) porphyrinsXu Liu, Lianghui Liu, Zikuan Wang, et al.
Frontiers in Chemistry|November 29, 2023
When do tripdoublet states fluoresce? A theoretical study of copper(II) porphyrinXingwen Wang, Chenyu Wu, Zikuan Wang, et al.
Journal of Chemical Theory and Computation|October 21, 2025
O1NumHess: A Fast and Accurate Seminumerical Hessian Algorithm Using Only O(1) GradientsBo Wang, Shaohang Luo, Zikuan Wang, et al.
Physical Chemistry Chemical Physics : PCCP|April 10, 2020
Chlorination versus hydroxylation selectivity mediated by the non-heme iron halogenase WelO5Xuan Zhang, Zikuan Wang, Jun Gao, et al.
The Journal of Chemical Physics|November 3, 2020
Analytic energy gradients of spin-adapted open-shell time-dependent density functional theoryZikuan Wang, Zhendong Li, Yong Zhang, et al.
Pageof 4

Showing results (1-10 of 39) with videos related to

Sort By:
Pageof 4
The Journal of Chemical Physics|May 8, 2023
Development of NOTCH, an all-electron, beyond-NDDO semiempirical method: Application to diatomic moleculesZikuan Wang, Frank Neese
Journal of Chemical Theory and Computation|July 9, 2021
iOI: An Iterative Orbital Interaction Approach for Solving the Self-Consistent Field ProblemZikuan Wang, Wenjian Liu
Dalton Transactions (Cambridge, England : 2003)|August 3, 2016
Light induced catalytic intramolecular hydrofunctionalization of allylphenols mediated by porphyrin rhodium(iii) complexesXu Liu, Zikuan Wang, Xuefeng Fu
Journal of Chemical Theory and Computation|October 4, 2024
Efficient and Robust Ab Initio Self-Consistent Field Acceleration Algorithm Based on a Semiempirical Model HamiltonianLangyuan Qin, Zikuan Wang, Bingbing Suo
Accounts of Chemical Research|August 27, 2021
NAC-TDDFT: Time-Dependent Density Functional Theory for Nonadiabatic CouplingsZikuan Wang, Chenyu Wu, Wenjian Liu
Chemical Communications (Cambridge, England)|June 27, 2015
Visible light promoted hydration of alkynes catalyzed by rhodium(III) porphyrinsXu Liu, Lianghui Liu, Zikuan Wang, et al.
Frontiers in Chemistry|November 29, 2023
When do tripdoublet states fluoresce? A theoretical study of copper(II) porphyrinXingwen Wang, Chenyu Wu, Zikuan Wang, et al.
Journal of Chemical Theory and Computation|October 21, 2025
O1NumHess: A Fast and Accurate Seminumerical Hessian Algorithm Using Only O(1) GradientsBo Wang, Shaohang Luo, Zikuan Wang, et al.
Physical Chemistry Chemical Physics : PCCP|April 10, 2020
Chlorination versus hydroxylation selectivity mediated by the non-heme iron halogenase WelO5Xuan Zhang, Zikuan Wang, Jun Gao, et al.
The Journal of Chemical Physics|November 3, 2020
Analytic energy gradients of spin-adapted open-shell time-dependent density functional theoryZikuan Wang, Zhendong Li, Yong Zhang, et al.
Pageof 4