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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 28, 1974 - Issue 4
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Original Articles

The O-H distance in ice

E. Whalley Division of Chemistry, National Research Council of Canada, Ottawa, K1A 0R9
Pages 1105-1108 | Received 07 Mar 1974, Published online: 22 Aug 2006

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Janos Mink, Andras Stirling, Dickson O. Ojwang, Gunnar Svensson, Judith Mihály, Csaba Németh, Markus Drees & Laszlo Hajba. (2019) Vibrational properties and bonding analysis of copper hexacyanoferrate complexes in solid state. Applied Spectroscopy Reviews 54:5, pages 369-424.
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A.Y. Wu, E. Whalley & G. Dolling. (1982) Neutron diffraction of heavy water to 15·6 kbar. Molecular Physics 47:3, pages 603-628.
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J.G. Powles. (1981) The structure of the water molecule in liquid water. Molecular Physics 42:4, pages 757-765.
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EdwinS. Campbell & Mihaly Mezei. (1980) A cooperative calculation and analysis of electric fields, induced dipole vectors and lattice energies for rotationally ordered ices IX, II and disordered Ih. Molecular Physics 41:4, pages 883-905.
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G. Walford, J.H. Clarke & J.C. Dore. (1977) The structure of the heavy water molecule from neutron-diffraction measurements. Molecular Physics 33:1, pages 25-30.
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Articles from other publishers (30)

P. E. Mason & J. W. Brady. (2007) “Tetrahedrality” and the Relationship between Collective Structure and Radial Distribution Functions in Liquid Water. The Journal of Physical Chemistry B 111:20, pages 5669-5679.
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George S. Fanourgakis & Sotiris S. Xantheas. (2006) The bend angle of water in ice Ih and liquid water: The significance of implementing the nonlinear monomer dipole moment surface in classical interaction potentials. The Journal of Chemical Physics 124:17.
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Jer-Lai Kuo, Michael L. Klein & Werner F. Kuhs. (2005) The effect of proton disorder on the structure of ice-Ih: A theoretical study. The Journal of Chemical Physics 123:13.
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Humberto Saint-Martin, Berk Hess & Herman J. C. Berendsen. (2004) An application of flexible constraints in Monte Carlo simulations of the isobaric–isothermal ensemble of liquid water and ice Ih with the polarizable and flexible mobile charge densities in harmonic oscillators model. The Journal of Chemical Physics 120:23, pages 11133-11143.
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Bertil Halle, Vladimir P. Denisov & Kandadai Venu. 2002. Biological Magnetic Resonance. Biological Magnetic Resonance 419 484 .
Bernd G. Pfrommer, Francesco Mauri & Steven G. Louie. (1999) NMR Chemical Shifts of Ice and Liquid Water:  The Effects of Condensation. Journal of the American Chemical Society 122:1, pages 123-129.
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Noam Agmon. (1999) Proton Solvation and Proton Mobility. Israel Journal of Chemistry 39:3-4, pages 493-502.
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Vladimir P. Denisov, Kandadai Venu, Jörg Peters, Hans Dietrich Hörlein & Bertil Halle. (1997) Orientational Disorder and Entropy of Water in Protein Cavities. The Journal of Physical Chemistry B 101:45, pages 9380-9389.
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Nigel W. Moriarty & Gunnar Karlström. (1997) Geometry optimization of a water molecule in water. A combined quantum chemical and statistical mechanical treatment. The Journal of Chemical Physics 106:15, pages 6470-6474.
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Kandadai Venu, Vladimir P. Denisov & Bertil Halle. (1997) Water 1 H Magnetic Relaxation Dispersion in Protein Solutions. A Quantitative Assessment of Internal Hydration, Proton Exchange, and Cross-Relaxation . Journal of the American Chemical Society 119:13, pages 3122-3134.
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Andrzej Katrusiak. (1996) Rigid O Molecule Model of Anomalous Thermal Expansion of Ices . Physical Review Letters 77:21, pages 4366-4369.
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V M Nield & R W Whitworth. (1995) The structure of ice Ih from analysis of single-crystal neutron diffuse scattering. Journal of Physics: Condensed Matter 7:43, pages 8259-8271.
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V.M Nield. (1995) SXD single crystal diffuse scattering — more than just a pretty picture. Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment 354:1, pages 30-37.
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Francesco Sciortino & Giorgina Corongiu. (1993) Structure and dynamics in hexagonal ice: A molecular dynamics simulation with an ab initio polarizable and flexible potential . The Journal of Chemical Physics 98:7, pages 5694-5700.
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M. Antonio Floriano, D. D. Klug, Edward Whalley, E. C. Svensson, V. F. Sears & E. D. Hallman. (1987) Direct determination of the intramolecular O–D distance in ice Ih and Ic by neutron diffraction. Nature 329:6142, pages 821-823.
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Eugene S. Kryachko. (1986) On the red shift of OH stretching region vibrations in ice and water. International Journal of Quantum Chemistry 30:4, pages 495-508.
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M.S. Lehmann & B.E.F. Fender. (1986) Chemical physics employing neutron crystallographic methods. Physica B+C 137:1-3, pages 159-168.
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James D. Jorgensen, R. A. Beyerlein, Noboru Watanabe & T. G. Worlton. (1984) Structure of D2O ice VIII from i n   s i t u powder neutron diffraction . The Journal of Chemical Physics 81:7, pages 3211-3214.
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Yukio Tanaka, Norio Ohtomo & Kiyoshi Arakawa. (1984) The Structure of Liquid Alcohols by Neutron Diffraction. I. Molecular Structure of Methyl Alcohol. Bulletin of the Chemical Society of Japan 57:3, pages 644-647.
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H. Ernst, H. Pfeifer & S.P. Zhdanov. (1983) The structure and motion of water and hydroxyl groups in hydrosodalite. Zeolites 3:3, pages 209-213.
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M.R. Chowdhury, J.C. Dore & J.T. Wenzel. (1982) The structural characteristics of amorphous D2O ice by neutron diffraction. Journal of Non-Crystalline Solids 53:3, pages 247-265.
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D. Lankhorst, J. Schriever & J. C. Leyte. (2010) Determination of the Rotational Correlation Time of Water by Proton NMR Relaxation in H 2 17 O and Some Related Results . Berichte der Bunsengesellschaft für physikalische Chemie 86:3, pages 215-221.
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W. F. Kuhs & M. S. Lehmann. (1981) Bond-lengths, bond angles and transition barrier in ice Ih by neutron scattering. Nature 294:5840, pages 432-434.
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Shun-ichi Ikawa, Shuichi Yamazaki & Masao Kimura. (1981) The sum rule for dipolar absorptions and rotational kinetic energy of wate and some dipolar molecules in condensed phases. Chemical Physics 58:2, pages 275-281.
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D.T Edmonds, S.D Goren, A.A.L White & W.F Sherman. (1977) Nuclear quadrupole resonance of 2D and 17O in ices V, VI, VIII, and IX. Journal of Magnetic Resonance (1969) 27:1, pages 35-44.
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D.T Edmonds, S.D Goren, A.L Mackay, A.A.L White & W.F Sherman. (1976) The nuclear quadrupole resonance of 2D and 17O in Ice II. Journal of Magnetic Resonance (1969) 23:3, pages 505-514.
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Harry Pfeifer. (1976) Surface phenomena investigated by nuclear magnetic resonance. Physics Reports 26:7, pages 293-338.
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Jack Wenzel, C. U. Linderstrøm-Lang & Stuart A. Rice. (1975) Amorphous Solid Water: A Neutron Diffraction Study. Science 187:4175, pages 428-430.
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. (2017) Glaciological Literature. Journal of Glaciology 14:71, pages 343-371.
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Stuart A. Rice. 1975. Topics in Current Chemistry. Topics in Current Chemistry 109 200 .

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