Proton tunnelling and deuteration-induced phase transitions in hydrogen-bonded crystals

作者: Takasuke Matsuo , Akira Inaba , Osamu Yamamuro , Noriko Onoda-Yamamuro

DOI: 10.1088/0953-8984/12/40/304

关键词: ProtonIonQuantum tunnellingHydrogen bondChemistryProton transportInorganic chemistryHydrogenPhysical chemistryDeuteriumKinetic isotope effect

摘要: Experimental facts about appearance of new crystalline phases at low temperature related to deuterium substitution are collected and mechanisms the isotope effect discussed. Compounds considered (i) tri-alkali hydrogen selenates sulphates, (ii) ammonium hexachlorometallates, (iii) bromo- iodo-hydroxyphenalenone (iv) chromium dioxide. In (i), (iv), linear O-H-O bonds involved. Proton tunnelling is likely mechanism peculiar phase behaviour (i). Definitely plays an essential role in but not extreme situation (iv). (ii), rotational ion ingredient deuteration-induced transitions. The term proton cloud introduced describe quantum mechanical distribution nucleus bond multi-valley potential for ion.

参考文章(49)
A. Titze, G. Hinze, Roland Böhmer, The antiferroelectric phase transition in Rb3D(SO4)2 single crystals studied by 87Rb NMR Physical Review B. ,vol. 57, ,(1998) , 10.17877/DE290R-11797
Camille Sandorfy, Georg Friedrich Zundel, P. Schuster, The Hydrogen bond : recent developments in theory and experiments North-Holland , Sole distributors for the U.S.A. and Canada, American Elsevier. ,(1976)
Tadashi Sugawara, Takasuke Matsuo, Kenichi Kohno, Akira Inaba, Tomoyuki Mochida, Akira Izuoka, Calorimetric study of proton tunneling in solid 5-bromo-9- hydroxyphenalenone and deuteration-induced phase transitions in its deuteroxy analog Journal of Chemical Physics. ,vol. 108, pp. 9809- 9816 ,(1998) , 10.1063/1.476455
Yoshio Kume, Yuji Mlyazaki, Takasuke Matsuo, Hiroshi Suga, Low temperature heat capacities of ammonium hexachlorotellurate and its deuterated analogue Journal of Physics and Chemistry of Solids. ,vol. 53, pp. 1297- 1304 ,(1992) , 10.1016/0022-3697(92)90249-D
Tetsuo Asaji, Yoshio Kume, Kazuhiko Ohya, Takehiko Chiba, Structural phase transitions in deuterated ammonium hexachloroplumbate(IV), , studied by nuclear quadrupole resonance Journal of Physics: Condensed Matter. ,vol. 9, pp. 2563- 2569 ,(1997) , 10.1088/0953-8984/9/12/005
Y. Moritomo, Y. Tokura, N. Nagaosa, T. Suzuki, K. Kumagai, Role of the proton tunneling in the phase transition of K3D1−xHx(SO4)2 Journal of Low Temperature Physics. ,vol. 99, pp. 55- 70 ,(1995) , 10.1007/BF00753620
O. Yamamuro, T. Matsuo, H. Suga, W. I. F. David, R. M. Ibberson, A. J. Leadbetter, Neutron diffraction and calorimetric studies of methylammonium iodide Acta Crystallographica Section B-structural Science. ,vol. 48, pp. 329- 336 ,(1992) , 10.1107/S0108768192000260