Hydrogen Dynamics and Characterization of the Tetragonal-to-Orthorhombic Phase Transformation in Ammonia Borane

被引:31
作者
Paolone, Annalisa [1 ,2 ]
Palumbo, Oriele [1 ]
Rispoli, Pasquale
Cantelli, Rosario
Autrey, Tom [3 ]
机构
[1] Univ Roma La Sapienza, Dipartimento Fis, CNISM, I-00185 Rome, Italy
[2] CNR INFM, Lab Reg SuperMAT, Salerno, Italy
[3] Pacific NW Natl Lab, Richland, WA 99352 USA
关键词
THERMAL-DECOMPOSITION; MOLECULAR-DYNAMICS; AMINE BORANES; HIGH-PRESSURE; NMR; DEHYDROGENATION; TRANSITION; RELEASE; R3N.BH3; STORAGE;
D O I
10.1021/jp810708g
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The anelastic spectrum of ammonia borane (NH3BH3) was measured in the temperature range between 1.3 and 300 K. The structural phase transition near 220 K is accompanied by a substantial variation of the elastic modulus (25-30%) and a spike of the elastic energy dissipation. The order-disorder phase transformation that occurs with a minute hysteresis, 0.4 K between heating and cooling, is indicative of a first-order phase transformation with a narrow region of coexistence between the two phases. The kinetics of the transition was investigated in detail. In addition, a thermally activated relaxation peak is revealed around 100 K for a sample vibration frequency of similar to 1 kHz, which is attributed to the dynamics of the rotations and torsions of the NH3-BH3 groups. Finally, the time-dependent energy loss on heating after aging the sample below the structural phase-transformation temperature was interpreted in terms of annealing of dislocations.
引用
收藏
页码:5872 / 5878
页数:7
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