Shi L - Search Results

1

Mixed quantum/classical approach to OH-stretch inelastic incoherent neutron scattering spectroscopy for ambient and supercooled liquid water and ice Ih.

Shi L, Skinner JL. Shi L, et al. J Chem Phys. 2015 Jul 7;143(1):014503. doi: 10.1063/1.4923387. J Chem Phys. 2015. PMID: 26156484

2

Interpretation of IR and Raman line shapes for H2O and D2O ice Ih.

Shi L, Gruenbaum SM, Skinner JL. Shi L, et al. J Phys Chem B. 2012 Nov 29;116(47):13821-30. doi: 10.1021/jp3059239. Epub 2012 Oct 31. J Phys Chem B. 2012. PMID: 23057540

3

Proton disorder in ice Ih and inhomogeneous broadening in two-dimensional infrared spectroscopy.

Shi L, Skinner JL. Shi L, et al. J Phys Chem B. 2013 Dec 12;117(49):15536-44. doi: 10.1021/jp405860u. Epub 2013 Aug 28. J Phys Chem B. 2013. PMID: 23937451

4

Structure and OH-stretch spectroscopy of low- and high-density amorphous ices.

Tainter CJ, Shi L, Skinner JL. Tainter CJ, et al. Among authors: shi l. J Chem Phys. 2014 Apr 7;140(13):134503. doi: 10.1063/1.4869293. J Chem Phys. 2014. PMID: 24712797

5

Resonant vibrational energy transfer in ice Ih.

Shi L, Li F, Skinner JL. Shi L, et al. J Chem Phys. 2014 Jun 28;140(24):244503. doi: 10.1063/1.4883913. J Chem Phys. 2014. PMID: 24985650

6

Dielectric constant and low-frequency infrared spectra for liquid water and ice Ih within the E3B model.

Shi L, Ni Y, Drews SE, Skinner JL. Shi L, et al. J Chem Phys. 2014 Aug 28;141(8):084508. doi: 10.1063/1.4893792. J Chem Phys. 2014. PMID: 25173022

7

Hydrogen Bonding and OH-Stretch Spectroscopy in Water: Hexamer (Cage), Liquid Surface, Liquid, and Ice.

Tainter CJ, Ni Y, Shi L, Skinner JL. Tainter CJ, et al. Among authors: shi l. J Phys Chem Lett. 2013 Jan 3;4(1):12-7. doi: 10.1021/jz301780k. Epub 2012 Dec 13. J Phys Chem Lett. 2013. PMID: 26291204

8

Reparametrized E3B (Explicit Three-Body) Water Model Using the TIP4P/2005 Model as a Reference.

Tainter CJ, Shi L, Skinner JL. Tainter CJ, et al. Among authors: shi l. J Chem Theory Comput. 2015 May 12;11(5):2268-77. doi: 10.1021/acs.jctc.5b00117. J Chem Theory Comput. 2015. PMID: 26574425

9

Robustness of Frequency, Transition Dipole, and Coupling Maps for Water Vibrational Spectroscopy.

Gruenbaum SM, Tainter CJ, Shi L, Ni Y, Skinner JL. Gruenbaum SM, et al. Among authors: shi l. J Chem Theory Comput. 2013 Jul 9;9(7):3109-17. doi: 10.1021/ct400292q. Epub 2013 Jun 21. J Chem Theory Comput. 2013. PMID: 26583990

10

Two-dimensional infrared spectroscopy of neat ice Ih.

Shi L, Skinner JL, Jansen TL. Shi L, et al. Phys Chem Chem Phys. 2016 Feb 7;18(5):3772-9. doi: 10.1039/c5cp07264f. Epub 2016 Jan 14. Phys Chem Chem Phys. 2016. PMID: 26765972

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