Peng ZHANG
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Paper Publications
- [1] Investigation of the hydrogen bonding in ice Ih by the first-principles density function methods. J. Chem. Phys., 137, 044504, 2012.
- [2] A calculating proof on hydrogen bonding in ordinary ice by the first-principles density functional theory. RSC Adv., 3, 6646,
- [3] Dynamics simulation of the interaction between serine and water. J. Chem. Phys., 138, 205101, 2013.
- [4] New observations on hydrogen bonding in ice by density functional theory simulations. Chin. Phys. B, 23, 026103, 2013.
- [5] The normal modes of lattice vibrations of ice XI. Sci. Rep., 6, 29273, 2016.
- [6] Computing analysis of lattice vibrations of ice Ⅷ. RSC Adv., 7, 31789, 2017.
- [7] Computational assignments of lattice vibrations of ice Ic. RSC Adv., 7, 36801, 2017.
- [8] DFT simulations of the vibrational spectrum and hydrogen bonds of ice XIV. Molecules, 23, 1781, 2018.
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