期刊
CHEMICAL PHYSICS LETTERS
卷 319, 期 3-4, 页码 423-426出版社
ELSEVIER SCIENCE BV
DOI: 10.1016/S0009-2614(00)00065-8
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The mean squared displacements of the eta(6)-benzene ring in Cr(C6D6)(2) have been determined at. 10 temperatures; extrapolation of these displacements gives a zero-point energy of 0.89 kJ mol(-1). The individual barriers to rotation corresponding to these displacements have been determined and decrease with increasing temperature in accord with expansion of the material. (C) 2000 Elsevier Science B.V. All rights reserved.
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