Proton momentum distribution of liquid water from room temperature to the supercritical phase

被引:71
|
作者
Pantalei, C. [1 ,2 ]
Pietropaolo, A. [1 ,2 ]
Senesi, R. [1 ,2 ]
Imberti, S. [1 ,2 ]
Andreani, C. [1 ,2 ]
Mayers, J. [3 ]
Burnham, C. [4 ]
Reiter, G. [4 ]
机构
[1] Univ Roma Tor Vergata, Dipartimento Fis, I-00133 Rome, Italy
[2] Univ Roma Tor Vergata, Ctr NAST Nanosci Nanotecnol Strumentaz, I-00133 Rome, Italy
[3] Rutherford Appleton Lab, ISIS, Didcot OX11 0QX, Oxon, England
[4] Univ Houston, Dept Phys, Houston, TX 77204 USA
关键词
D O I
10.1103/PhysRevLett.100.177801
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Measurements of the proton momentum distribution n(p) in water from ambient conditions to above the supercritical point are compared with theoretical calculations based on a recently developed polarizable water model. The n(p) along the H-bond direction is narrower in the dense phases, and approaches that of the isolated molecule in the more dilute phases. The theoretical model, which includes only electrostatic interactions, is unable to explain the softening of the local potential experienced by the proton in the dense phases, but it accurately predicts the n(p) for the dilute phases.
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页数:4
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