1

S.-M. Bai, W.-W. Xie, and Q. Shi*

A New Trajectory Branching Approximation To Propagate the Mixed Quantum-Classical Liouville Equation

J. Phys. Chem. A 118, 9262-9271 (2014)

2

R.-H. Zheng, W.-M. Wei, L.-L. Zhu and Q. Shi

Theoretical study of the resonance Raman spectra for meso-tetrakis(3,5-di-tertiarybutylphenyl)-porphyrin

Spectrochimica acta. A 133, 707-13 (2014)

3

R.-H. Zheng, W.-M. Wei, H. Liu, Y.-Y. Jing and Q. Shi

Theoretical study of sum-frequency vibrational spectroscopy on limonene surface

J. Chem. Phys. 140, 104702 (2014)

4

W.-W. Xie, Y. Xu, L.-L. Zhu, and Q. Shi*

Mixed quantum classical calculation of proton transfer reaction rates: From deep tunneling to over the barrier regimes

J. Chem. Phys. 140, 174105 (2014)

5

H. Liu, L. –L. Zhu, S.-M. Bai, and Q. Shi*

Reduced quantum dynamics with arbitrary bath spectral densities: Hierarchical equations of motion based on several different bath decomposition schemes

J. Chem. Phys. 140, 134106 (2014)

6

S.-M. Bai, W.-W. Xie, and Q. Shi*

Calculation of absorption spectra involving multiple excited states: Approximate methods based on the mixed quantum classical Liouville equation

J. Chem. Phys. 140, 084105 (2014)