[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
More information about the XCrySDen
mailing list