Title of article
Flexible TIP4P model for molecular dynamics simulation of liquid water
Author/Authors
Lawrence، نويسنده , , C.P and Skinner، نويسنده , , J.L.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2003
Pages
6
From page
842
To page
847
Abstract
We have developed a flexible version of the TIP4P model for molecular dynamics simulations. The model does a reasonable job of reproducing the experimental peak frequencies and widths of the bend and stretch peaks in the infrared spectra for both liquid H2O and D2O.
Journal title
Chemical Physics Letters
Serial Year
2003
Journal title
Chemical Physics Letters
Record number
1784185
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