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Inter atomic force constants of $$beta$$-PbF$$_{2}$$ from diffuse neutron scattering measurement

中性子散乱法によって求めた$$beta$$-PbF$$_{2}$$の原子間力定数

Xianglian*; Bao, W.*; Guo, T.*; Li, P.*; 佐久間 隆*; 井川 直樹   

Xianglian*; Bao, W.*; Guo, T.*; Li, P.*; Sakuma, Takashi*; Igawa, Naoki

633Kにて$$beta$$-PbF$$_{2}$$の中性子散漫散乱実験を実施した結果、振動性のある散漫強度が観察された。この振動性散漫散乱は原子の熱振動に起因する相関効果によって説明することができ、この相関効果とDebye-Waller熱因子から計算して得られた、第1、第2最近接原子間の力定数は各々、0.36eV/$AA $^{2}$$ (距離; ${it r}$ = 2.599 $AA )$、0.21eV/$AA $^{2}$$ (${it r}$=3.001 $AA )$と求められた。

Diffuse neutron scattering measurements were performed on powder $$beta$$-PbF$$_{2}$$ at 633 K. Oscillatory diffuse scattering intensities were observed and the observed diffuse scattering intensities were explained by including the correlation effects among thermal displacements of atoms. The force constants among first- and second-nearest-neighboring atoms in $$beta$$-PbF$$_{2}$$ calculated from the values of correlation effects and Debye-Waller temperature parameters were determined as 0.36 eV/ $AA $^{2}$$ at ${it r}$ = 2.599 ${AA}$ and 0.21 eV/ $AA $^{2}$$ at ${it r}$ = 3.001 AA, respectively.

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