[Smeagol-discuss] error

[zhao_baoyi]

 Dears all,
 
   Here is the prolem as following:
 
superc: Internal auxiliary supercell:     3 x     3 x     1  =       9
superc: Number of atoms, orbitals, and projectors:    612  5580  5508
* Maximum dynamic memory allocated =     3 MB
siesta:                 ===============================
SMEAGOL                 Bias step =    0, V =  0.000 Ry
                            Begin CG move =      0
                        ===============================
superc: Internal auxiliary supercell:     3 x     3 x     1  =       9
superc: Number of atoms, orbitals, and projectors:    612  5580  5508
iodm: Reading Density Matrix from files
chkdim: ERROR: In iodm, dimension nbasis =     620. It must be exactly      236
Stopping Program
I am puzzled about it .Can you help me find the ways to solve it.


 
 
 
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