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85037885016
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The structure was solved by direct methods and refined by full-matrix least-squares methods on (Formula presented) with statistical weighting, anisotropic displacement parameters for all nonhydrogen atoms, and constrained isotropic H atoms to give (Formula presented) on all data, conventional (Formula presented) on (Formula presented) goodness of fit (Formula presented) for all (Formula presented) values and 1046 refined parameters. Programs employed: Siemens SMART and SAINT control and integration software (Siemens Analytical x-ray Instruments, Inc.), and Siemens SHELXTL-PLUS structure solution and refinement software (Siemens Industrial Automation Inc.).
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The structure was solved by direct methods and refined by full-matrix least-squares methods on (Formula presented) with statistical weighting, anisotropic displacement parameters for all nonhydrogen atoms, and constrained isotropic H atoms to give (Formula presented) on all data, conventional (Formula presented) on (Formula presented) goodness of fit (Formula presented) for all (Formula presented) values and 1046 refined parameters. Programs employed: Siemens SMART and SAINT control and integration software (Siemens Analytical x-ray Instruments, Inc.), and Siemens SHELXTL-PLUS structure solution and refinement software (Siemens Industrial Automation Inc.).
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30
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85037904535
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Only the acoustic modes of lattice vibrations contribute to the lattice specific heat at low temperatures, so that a model with 1 atom per cell is adequate.
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Only the acoustic modes of lattice vibrations contribute to the lattice specific heat at low temperatures, so that a model with 1 atom per cell is adequate.
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31
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0039595975
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Erickson, N.E.3
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33
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85037881351
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The magnetization of the paramagnetic ions was assumed to follow the Brillouin function, with the actual temperature T. As a consequence, the low-field susceptibility obeyed the Curie law. The fits of the 2 K magnetization were carried out using Brillouin functions for various assumed values for the spin S of the paramagnetic ions. To obtain good fits it was necessary to adjust the g factor, in addition to (Formula presented) The values for (Formula presented) were practically independent of S, and were close to those obtained from the procedure which used the modified Brillouin function of Ref. 27. Although the results for the g values did depend on S, the calculated susceptibility of the paramagnetic ions was practically independent of S
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The magnetization of the paramagnetic ions was assumed to follow the Brillouin function, with the actual temperature T. As a consequence, the low-field susceptibility obeyed the Curie law. The fits of the 2 K magnetization were carried out using Brillouin functions for various assumed values for the spin S of the paramagnetic ions. To obtain good fits it was necessary to adjust the g factor, in addition to (Formula presented) The values for (Formula presented) were practically independent of S, and were close to those obtained from the procedure which used the modified Brillouin function of Ref. 27. Although the results for the g values did depend on S, the calculated susceptibility of the paramagnetic ions was practically independent of S.
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