[Smeagol-discuss] Problem: Leads decimation

asa aravindh mails2asa at gmail.com
Mon Feb 23 10:42:40 GMT 2009


Dear all..
 I have been trying to run transport calculation of Fe nanowire grown in the
bcc-110 direction . The leads part is running successfully , but while going
to the scattering part, the program stops at certain point..printing these
lines in the output


* Maximum dynamic memory allocated =     1 MB

siesta:                 ===============================
SMEAGOL                 Bias step =    0, V =  0.000 Ry
                            Begin CG move =      0
                        ===============================

InitMesh: MESH =   288 x   200 x    36 =     2073600
InitMesh: Mesh cutoff (required, used) =   200.000   210.295 Ry

* Maximum dynamic memory allocated =   173 MB
gensvd: Leads decimation
gensvd: Dim of H1 and S1 :    135
gensvd: Rank of H1:            26
gensvd: Rank of (H1,S1):       89
gensvd: Decimated states:      20
gensvd: Decimation from the right
gensvd: Leads decimation
gensvd: Dim of H1 and S1 :    135
gensvd: Rank of H1:            26
gensvd: Rank of (H1,S1):       89
gensvd: Decimated states:      20
gensvd: Decimation from the right
gensvd: Leads decimation
gensvd: Dim of H1 and S1 :    135
gensvd: Rank of H1:            26
gensvd: Rank of (H1,S1):       89
gensvd: Decimated states:      20
gensvd: Decimation from the right
gensvd: Leads decimation
gensvd: Dim of H1 and S1 :    135
gensvd: Rank of H1:            26
gensvd: Rank of (H1,S1):       89
gensvd: Decimated states:      20
gensvd: Decimation from the right
p0_7749:  p4_error: interrupt SIGSEGV: 11

I am attaching my input files along with..Can anybody point out wat is going
wrong??

Thanks in advance
asa
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