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Hello All,
I want to make a cluster whose symmetry is icosahedron. When i do an MD run the symmetry is disturbed,and I am not getting ground state minimisation. What should be done for this? my INCAR file is as follows
System = (Pd)13
ISTART = 0
NELMIN = 8
EDIFF = 1E-8
EDIFFG = -0.0001
NSW = 100
MAXMIX = 80
IBRION = 0
POTIM = 2.0
NFREE = 10
ISMEAR = 0

Thanks in advance

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