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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 58, 1986 - Issue 4
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Original Articles

Molecular dynamics simulation of plastic adamantane

II. Reorientation motion

M. Meyer Laboratoire de Physique des Matériaux, C.N.R.S., 1, Place Aristide Briand, 92195, Meudon Principal Cedex, France
,
C. Marhic Laboratoire de Physique des Matériaux, C.N.R.S., 1, Place Aristide Briand, 92195, Meudon Principal Cedex, France
&
G. Ciccotti Dipartimento di Fisica G. Marconi, Universita di Roma, ‘La Sapienza’, Piazzale A. Moro 2, 00185, Roma, Italy
Pages 723-733 | Received 03 Mar 1986, Accepted 18 Mar 1986, Published online: 22 Aug 2006

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C. MOON, G.S. PAWLEY & J. CRAIN. (2001) Reorientational motion in binary mixtures: molecular dynamics simulations. Molecular Physics 99:24, pages 2037-2044.
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DAVID CATHIAUX, FRANJO SOKOLI[Cgrave]MARC DESCAMPS & AURÉLIEN PERERA. (1999) A molecular dynamics study of model cyanoadamantane. Molecular Physics 96:7, pages 1033-1042.
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DAVID W. GREIG. (1996) Molecular dynamics simulations of the order-disorder phase transition in adamantane. Molecular Physics 89:3, pages 677-689.
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A. Criado & A. Muñoz. (1994) A molecular dynamics simulation of the plastic phase of hexachloroethane. Molecular Physics 83:4, pages 815-833.
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Articles from other publishers (16)

Yating Zhou, Rhian Patterson, P. Andrew Williams, Benson M. Kariuki, Colan E. Hughes, Ranita Samanta, Ramesh Devarapalli, C. Malla Reddy, David C. Apperley & Kenneth D. M. Harris. (2019) Temperature-Dependent Structural Properties, Phase Transition Behavior, and Dynamic Properties of a Benzene Derivative in the Solid State. Crystal Growth & Design 19:4, pages 2155-2162.
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Hassan Sabzyan & Behnaz Saed. (2014) Computational study of adamantanes using floating basis functions. Structural Chemistry 25:4, pages 1207-1216.
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A. V. Chadwick. 2003. digital Encyclopedia of Applied Physics. digital Encyclopedia of Applied Physics.
A. Würflinger. (2010) Monte Carlo Simulation of the Rotator Phase of Cyclohexane. Berichte der Bunsengesellschaft für physikalische Chemie 99:6, pages 821-826.
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Krzysztof Rapcewicz & Jerzy Przystawa. (1995) On the order-disorder transition in crystalline adamantane C10H16. Physica B: Condensed Matter 205:1, pages 115-120.
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Wolfgang Breymann & Robert M. Pick. (1994) A realistic molecular dynamics simulation of the plastic crystalline phase of neopentane. II. Individual orientational dynamics. The Journal of Chemical Physics 100:3, pages 2232-2243.
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Mauro Ferrario. 1991. Computer Simulation in Materials Science. Computer Simulation in Materials Science 381 393 .
O. B. M. Hardouin Duparc & M. Meyer. (1990) Molecular dynamics of a plastic crystal with two types of orientational disorder: Static and dynamic properties of plastic bicyclooctane. The Journal of Chemical Physics 93:2, pages 1313-1324.
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M. Meyer. 1989. Computer Modelling of Fluids Polymers and Solids. Computer Modelling of Fluids Polymers and Solids 335 355 .
J. Philibert. 1990. Diffusion in Materials. Diffusion in Materials 1 34 .
K. O. Prins. 1991. High Pressure NMR. High Pressure NMR 29 84 .
W. Breymann & R. M. Pick. (1989) A realistic molecular dynamics simulation of the plastic crystalline phase of neopentane. I. The model and its static properties. The Journal of Chemical Physics 91:5, pages 3119-3132.
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David Salmon, Victoria L. Shannon & Herbert L. Strauss. (1989) The C–H infrared stretching bands of ordered and disordered phases of adamantane. The Journal of Chemical Physics 90:2, pages 773-782.
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D van der Putten & K.O Prins. (1988) 13C cross polarization and spin relaxation in adamantane at pressures up to 7 kbar. Journal of Magnetic Resonance (1969) 77:3, pages 550-561.
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Martin Dove. 1988. Physical Properties and Thermodynamic Behaviour of Minerals. Physical Properties and Thermodynamic Behaviour of Minerals 501 590 .
Giovanni Ciccotti, Mauro Ferrario, Elisabetta Memeo & Madeleine Meyer. (1987) Structural Transition on Cooling of Plastic Adamantane: A Molecular-Dynamics Study. Physical Review Letters 59:22, pages 2574-2577.
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