You can also try to use VMD in the case of frequency or MD calculations, you would also be able to export a movie. Cite. 1 Recommendation. 29th Jan, 2018. Binod Nepal. City College of New York.
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VMD 1.9.1 is installed on Proteus. You must be running an X11 server on your own computer for this to work: Linux should just work, Mac OS X will need XQuartz, Windows will need XMing or similar. It works best over a fast network. Use the module file: vmd/1.9.1 Read Documentation.
Dear all, I would like to know if there is a way to create/export a movie from a XDATCAR file in VNL. Thank You, Fernando Soto
Dear Thomas Thanks very much. Great, It works well. I think it will attract more people to switch from VMD to Pymol. Possibly, since the new version of VASP have change the format of XDATCAR, a update of VMD plugin may be needed. A stupid question: When the pymol read the CHGCAR file, it will produce a set of data like spin up+down and spin up ...
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vasp轨迹文件的格式经常变动, 这样导致和vmd的插件不兼容, 查看的时候只能显示一帧. 我最近使用的vasp 5.4.4输出的轨迹文件XDATCAR就存在这个问题. 为了解决这个问题, 我写了一个简单的脚本, 将XDATCAR转换为gromacs格式以便使用vmd查看.