Yu Zhai, B. Sc.
Affiliations: | 2011-2015 | College of Chemistry | Jilin University, PR China |
2015- | Institute of Theoretical Chemistry | Jilin University, PR China |
Area:
Theoretical Chemistry, Spectroscopy, Molecular Dynamics, Molecular VibrationWebsite:
http://www.zhaiyusci.net/Google:
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Publications
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Li J, Zeng T, Zhai Y, et al. (2023) Intermolecular resonance energy transfer between two lutein pigments in light-harvesting complex II studied by frenkel exciton models. Physical Chemistry Chemical Physics : Pccp |
Hou D, Zhai Y, Sun TT, et al. (2022) Vibrationally excited intermolecular potential energy surfaces and the predicted near infrared overtone ( = 2 ← 0) spectra of a HO-Ne complex. Physical Chemistry Chemical Physics : Pccp |
Wang L, Zhang XL, Zhai Y, et al. (2020) Explicitly correlated ab initio potential energy surface and predicted rovibrational spectra for HO-N and DO-N complexes. The Journal of Chemical Physics. 153: 054303 |
Hou D, Yang JT, Zhai Y, et al. (2020) Analytic intermolecular potential energy surface and first-principles prediction of the rotational profiles for a symmetric top ion-atom complex: A case study of HO-Ar. The Journal of Chemical Physics. 152: 214302 |
Zhang XL, Ma YT, Zhai Y, et al. (2019) Full quantum calculation of the rovibrational states and intensities for a symmetric top-linear molecule dimer: Hamiltonian, basis set, and matrix elements. The Journal of Chemical Physics. 151: 074301 |
Zhang XL, Ma YT, Zhai Y, et al. (2019) Erratum: "Analytic Morse/long-range potential energy surfaces and 'adiabatic-hindered-rotor' treatment for a symmetric top-linear molecule dimer: A case study of CHF-H" [J. Chem. Phys. 148, 124302 (2018)]. The Journal of Chemical Physics. 150: 209901 |
Zhang XL, Ma YT, Zhai Y, et al. (2018) Analytic Morse/long-range potential energy surfaces and "adiabatic-hindered-rotor" treatment for a symmetric top-linear molecule dimer: A case study of CHF-H. The Journal of Chemical Physics. 148: 124302 |
Liu JM, Zhang XL, Zhai Y, et al. (2018) Theoretical Study of Infrared Spectra of OCS-(pH), OCS-(oD), OCS-(HD)and Mixed OCS-pH-He Trimers. The Journal of Physical Chemistry. A |
Liu JM, Zhai Y, Zhang XL, et al. (2018) Intermolecular configurations dominated by quadrupole-quadrupole electrostatic interactions: explicit correlation treatment of the five-dimensional potential energy surface and infrared spectra for the CO-N2 complex. Physical Chemistry Chemical Physics : Pccp |
Zhai Y, Li H, Le Roy R J. (2018) Constructing high-accuracy intermolecular potential energy surface with multi-dimension Morse/Long-Range model Molecular Physics. 116: 843 |