[xcrysden] please I need a help

Erwin Rossen erwin.rossen at gmail.com
Wed Feb 10 12:19:17 CET 2010


Hello!

I have an xyz file which starts with:

     52 # atoms  within limits=cell_PL
Ag              0.000000    0.000000    0.000000
Ag              1.467250   -0.847120    2.396000
Ag             -1.467250   -0.847120    2.396000
Ag              0.000000    1.694230    2.396000
Ag             -1.467250    0.847110    4.792010
Ag              0.000000   -1.694230    4.792010
....

XCrySDen does not open this. How should I change the header such that
XCrySDen can open it?

Best,
Erwin Rossen


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