(Q51887832)

16 April 2018

title

The vibrational proton potential in bulk liquid water and ice. (English)

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author name string

C J Burnham

1

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D J Anick

2

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P K Mankoo

3

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G F Reiter

4

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language of work or name

English

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publication date

1 April 2008

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16 April 2018

Journal of Chemical Physics

published in

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volume

128

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issue

15

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page(s)

154519

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Molecular-dynamics study of atomic motions in water

cites work

1 reference

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21 January 2018

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21 January 2018

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Hydrogen bonding and Raman, IR, and 2D-IR spectroscopy of dilute HOD in liquid D2O

21 January 2018

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Collective solvent coordinates for the infrared spectrum of HOD in D2O based on an ab initio electrostatic map.

21 January 2018

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Calculation of heat capacities of light and heavy water by path-integral molecular dynamics.

21 January 2018

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A quantitative account of quantum effects in liquid water.

21 January 2018

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On the origin of the redshift of the OH stretch in Ice Ih: evidence from the momentum distribution of the protons and the infrared spectral density.

21 January 2018

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Proton momentum distribution in water: an open path integral molecular dynamics study.

21 January 2018

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Quantum Calculations On Hydrogen Bonds In Certain Water Clusters Show Cooperative Effects

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21 January 2018

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Path integrals in the theory of condensed helium

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Low density solid ozone

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The formulation of quantum statistical mechanics based on the Feynman path centroid density. I. Equilibrium properties

21 January 2018

1 reference

The formulation of quantum statistical mechanics based on the Feynman path centroid density. II. Dynamical properties

21 January 2018

1 reference

Quantum corrections to classical time-correlation functions: hydrogen bonding and anharmonic floppy modes.

21 January 2018

1 reference

The properties of ion-water clusters. I. The protonated 21-water cluster

21 January 2018

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The structure of the first coordination shell in liquid water

21 January 2018

1 reference

Polarizable molecules in the vibrational spectroscopy of water

21 January 2018

1 reference

Ab initio dipole polarizability surfaces of water molecule: static and dynamic at 514.5 nm.

21 January 2018

1 reference

Infrared Intensities of Liquids XX: The Intensity of the OH Stretching Band of Liquid Water Revisited, and the Best Current Values of the Optical Constants of H2O(l) at 25°C between 15,000 and 1 cm−1

21 January 2018

1 reference

Quantum and classical relaxation rates from classical simulations

21 January 2018

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Computer simulation and the dielectric constant of polarizable polar systems

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.2895750

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16 April 2018

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16 April 2018