Accurate prediction and measurement of vibronic branching ratios for laser cooling linear polyatomic molecules C Zhang, BL Augenbraun, ZD Lasner, NB Vilas, JM Doyle, L Cheng The Journal of Chemical Physics 155 (9), 2021 | 41 | 2021 |
Branching Ratios, Radiative Lifetimes, and Transition Dipole Moments for YbOH ET Mengesha, AT Le, TC Steimle, L Cheng, C Zhang, BL Augenbraun, ... The Journal of Physical Chemistry A 124 (16), 3135-3148, 2020 | 32 | 2020 |
Optical Trapping of a Polyatomic Molecule in an -Type Parity Doublet State C Hallas, NB Vilas, L Anderegg, P Robichaud, A Winnicki, C Zhang, ... Physical Review Letters 130 (15), 153202, 2023 | 30 | 2023 |
Calculations of time-reversal-symmetry-violation sensitivity parameters based on analytic relativistic coupled-cluster gradient theory C Zhang, X Zheng, L Cheng Physical Review A 104 (1), 012814, 2021 | 29 | 2021 |
Atomic Mean-Field Approach within Exact Two-Component Theory Based on the Dirac–Coulomb–Breit Hamiltonian C Zhang, L Cheng The Journal of Physical Chemistry A 126 (27), 4537-4553, 2022 | 27 | 2022 |
Analytic evaluation of energy first derivatives for spin–orbit coupled-cluster singles and doubles augmented with noniterative triples method: General formulation and an … J Liu, X Zheng, A Asthana, C Zhang, L Cheng The Journal of Chemical Physics 154 (6), 2021 | 23 | 2021 |
Vibronic branching ratios for nearly closed rapid photon cycling of SrOH Z Lasner, A Lunstad, C Zhang, L Cheng, JM Doyle Physical Review A 106 (2), L020801, 2022 | 20 | 2022 |
Performance of an atomic mean-field spin–orbit approach within exact two-component theory for perturbative treatment of spin–orbit coupling C Zhang, L Cheng Molecular Physics 118 (19-20), e1768313, 2020 | 20 | 2020 |
Inner-shell excitation in the YbF molecule and its impact on laser cooling C Zhang, C Zhang, L Cheng, TC Steimle, MR Tarbutt Journal of Molecular Spectroscopy 386, 111625, 2022 | 18 | 2022 |
Towards accurate prediction for laser-coolable molecules: relativistic coupled-cluster calculations for yttrium monoxide and prospects for improving its laser cooling efficiencies C Zhang, H Korslund, Y Wu, S Ding, L Cheng Physical Chemistry Chemical Physics 22 (45), 26167-26177, 2020 | 15 | 2020 |
Route to chemical accuracy for computational uranium thermochemistry C Zhang, L Cheng Journal of Chemical Theory and Computation 18 (11), 6732-6741, 2022 | 12 | 2022 |
Benchmark relativistic delta-coupled-cluster calculations of K-edge core-ionization energies of third-row elements X Zheng, C Zhang, Z Jin, SH Southworth, L Cheng Physical Chemistry Chemical Physics 24 (22), 13587-13596, 2022 | 12 | 2022 |
Intensity-borrowing mechanisms pertinent to laser cooling of linear polyatomic molecules C Zhang, NR Hutzler, L Cheng Journal of Chemical Theory and Computation 19 (13), 4136–4148, 2023 | 11 | 2023 |
Mapping the Electronic Structure of the Uranium(VI) Dinitride Molecule, UN2 G Liu, C Zhang, SM Ciborowski, A Asthana, L Cheng, KH Bowen The Journal of Physical Chemistry A 124 (32), 6486-6492, 2020 | 11 | 2020 |
Geometry optimizations with spinor-based relativistic coupled-cluster theory X Zheng, C Zhang, J Liu, L Cheng The Journal of Chemical Physics 156 (15), 2022 | 10 | 2022 |
Cholesky Decomposition-Based Implementation of Relativistic Two-Component Coupled-Cluster Methods for Medium-Sized Molecules C Zhang, F Lipparini, S Stopkowicz, J Gauss, L Cheng Journal of Chemical Theory and Computation 20 (2), 787–798, 2024 | 8 | 2024 |
Blackbody thermalization and vibrational lifetimes of trapped polyatomic molecules NB Vilas, C Hallas, L Anderegg, P Robichaud, C Zhang, S Dawley, ... Physical Review A 107 (6), 062802, 2023 | 8 | 2023 |
Analytic gradients for relativistic exact-two-component equation-of-motion coupled-cluster singles and doubles method C Zhang, X Zheng, J Liu, A Asthana, L Cheng The Journal of Chemical Physics 159 (24), 2023 | 6 | 2023 |
Multiphoton Control of 6π Photocyclization via State-Dependent Reactant–Product Correlations RP Brady, C Zhang, JR DeFrancisco, BJ Barrett, L Cheng, AE Bragg The Journal of Physical Chemistry Letters 12 (39), 9493-9500, 2021 | 5 | 2021 |
Comparison of state-interaction and spinor-representation calculations of spin-orbit coupling within exact two-component coupled-cluster theories Z Lin, C Zhang, L Cheng Molecular Physics, e2256423, 2023 | 3 | 2023 |