[Smeagol-discuss] Running problem

[Christian helman]

Hi smeagol fellows
I'm having problems running my system. I have already obtain the leads
without problems but when I run the transport calculation I obtain several
errors
In the output of cluster queue:

 forrtl: warning (402): fort: (1): In call to YLMEXP, an array temporary was
created for argument #11
....... (several times)

forrtl: warning (402): fort: (1): In call to YLMEXP, an array temporary was
created for argument #11

forrtl: severe (408): fort: (2): Subscript #1 of the array INDXUO has value
1694 which is greater than the upper bound of 397

Image              PC                Routine            Line
Source
smeagol.1.0bP      0000000000B17390  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000B1525E  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AFA0CA  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AC33BF  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AC35FB  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000626488  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000052AEC5  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000715D8C  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000040CF2A  Unknown               Unknown  Unknown
libc.so.6          0000003FE7B1C4BB  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000040CE6A  Unknown               Unknown  Unknown
forrtl: severe (408): fort: (2): Subscript #1 of the array INDXUO has value
1694 which is greater than the upper bound of 397

Image              PC                Routine            Line
Source
smeagol.1.0bP      0000000000B17390  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000B1525E  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AFA0CA  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AC33BF  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AC35FB  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000626488  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000052AEC5  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000715D8C  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000040CF2A  Unknown               Unknown  Unknown
libc.so.6          0000003F65D1C4BB  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000040CE6A  Unknown               Unknown  Unknown
forrtl: severe (408): fort: (2): Subscript #1 of the array INDXUO has value
1793 which is greater than the upper bound of 397

Image              PC                Routine            Line
Source
smeagol.1.0bP      0000000000B17390  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000B1525E  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AFA0CA  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AC33BF  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AC35FB  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000626488  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000052AEC5  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000715D8C  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000040CF2A  Unknown               Unknown  Unknown
libc.so.6          0000003FE7B1C4BB  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000040CE6A  Unknown               Unknown  Unknown
forrtl: severe (408): fort: (2): Subscript #1 of the array INDXUO has value
1793 which is greater than the upper bound of 397

Image              PC                Routine            Line
Source
smeagol.1.0bP      0000000000B17390  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000B1525E  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AFA0CA  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AC33BF  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000AC35FB  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000626488  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000052AEC5  Unknown               Unknown  Unknown
smeagol.1.0bP      0000000000715D8C  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000040CF2A  Unknown               Unknown  Unknown
libc.so.6          0000003F65D1C4BB  Unknown               Unknown  Unknown
smeagol.1.0bP      000000000040CE6A  Unknown               Unknown  Unknown
-------------------------------------------------------------------------------------------------------------

After that the run stop. The last lines of the output file (case.out) are:

superc: Internal auxiliary supercell:     5 x     5 x     1  =      25
superc: Number of atoms, orbitals, and projectors:    675  9925 10800

InitMesh: MESH =    40 x    40 x   250 =      400000
InitMesh: Mesh cutoff (required, used) =   250.000   258.900 Ry
---------------------------------------------------------------------------------------------------------------

Smeagol is compiled with MPICH 2.0 as you describe in the wiki page.
do you have any idea?
Thank in advance!!

-- 
Lic. Christian Helman
Unidad de Actividad Física
Centro Atómico Constituyentes-CNEA
Argentina
Tel:++54-11-6772-7102
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