[Wien] How to select the isovalue of isosurface ?

钟国华 zhgh at theory.issp.ac.cn
Tue Dec 25 02:24:35 CET 2007


Dear all,

Merry Christmas!

As using the xcrysden to plot the 3D charge density, the isovalue of
isosurface is adjustive. Would you please tell me how to select the
isovalue? What determines this isovalue ? Whether is the selection of
isovalue related to the covalent or ionic interaction?

Thanks for any helps!

Best Wishes!
Yours sincerely,
Zhong


-- 
=====================================================
Mr. GuoHua Zhong
Address:
    Key Laboratory of Materials Physics,Institute
    of Solid State Physics, Chinese Academy of Sciences
    Hefei, Anhui P.O.Box 1129, 230031 P. R. China
Telephone:
    86-551-5591464 (Office)
E-Mail:
    zhgh at theory.issp.ac.cn





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