[Wien] page faults
jadhikari@clarku.edu
jadhikari at clarku.edu
Mon Feb 19 17:01:42 CET 2007
Dear Wien users,
Below is the time file for the calculation involving NaNbO3 molecule in a
multi-processor environment. It works sometimes only in a single mode but
never in a parallel mode.
__________________________________________________________________________
1.811u 1.557s 0:47.99 7.0% 0+0k 0+0io 1pf+0w
node2(1) 2127.446u 7.367s 1:20:44.49 44.0% 0+0k 0+0io 17326pf+0w
node3(1) 2098.011u 9.707s 1:15:39.95 46.4% 0+0k 0+0io 28870pf+0w
node4(1) 2169.745u 10.399s 1:33:38.41 38.8% 0+0k 0+0io 57717pf+0w
node2(1) 2187.289u 6.391s 1:11:51.44 50.8% 0+0k 0+0io 28990pf+0w
node3(1) 2059.633u 4.504s 50:04.62 68.6% 0+0k 0+0io 7309pf+0w
__________________________________________________________________________
Here we see that the system stops showing a lot of pagefaults. The error
is in LAPW1.
I would be happy if you could point out the possible sources of these faults.
Thanking you.
Subin
WFFIL (WFPRI, SUPWF)
7.00 10 4 (R-MT*K-MAX; MAX L IN WF, V-NMT
.08747 3 0 global e-param with N other choices, napw
0 -3.311 0.002 CONT 1
1 -1.155 0.000 CONT 1
2 -1.853 0.000 CONT 1
.08747 3 0 global e-param with N other choices, napw
0 -3.180 0.002 CONT 1
1 -1.115 0.000 CONT 1
2 -2.916 0.000 CONT 1
.08747 3 0 global e-param with N other choices, napw
0 -3.663 0.002 CONT 1
1 -1.855 0.000 CONT 1
2 0.680 0.000 CONT 1
.08747 2 0 global e-param with N other choices, napw
0 -0.740 0.000 CONT 1
1 0.180 0.000 CONT 1
.08747 2 0 global e-param with N other choices, napw
0 -0.740 0.000 CONT 1
1 0.200 0.000 CONT 1
.08747 2 0 global e-param with N other choices, napw
0 -0.810 0.000 CONT 1
1 0.223 0.000 CONT 1
.08747 2 0 global e-param with N other choices, napw
0 -0.736 0.000 CONT 1
1 0.320 0.000 CONT 1
K-VECTORS FROM UNIT:4 -9.0 2.0 emin/emax window
Sodium Niobate
P LATTICE,NONEQUIV.ATOMS: 757_Pbcm
MODE OF CALC=RELA unit=bohr
10.404800 10.518200 29.328600 90.000000 90.000000 90.000000
ATOM -1: X=0.24300000 Y=0.75000000 Z=0.00000000
MULT= 4 ISPLIT= 8
-1: X=0.75700000 Y=0.25000000 Z=0.00000000
-1: X=0.24300000 Y=0.75000000 Z=0.50000000
-1: X=0.75700000 Y=0.25000000 Z=0.50000000
Na1 NPT= 781 R0=0.00010000 RMT= 2.5000 Z: 11.0
LOCAL ROT MATRIX: 0.0000000 0.0000000 1.0000000
1.0000000 0.0000000 0.0000000
0.0000000 1.0000000 0.0000000
ATOM -2: X=0.23900000 Y=0.78200000 Z=0.25000000
MULT= 4 ISPLIT= 8
-2: X=0.76100000 Y=0.21800000 Z=0.75000000
-2: X=0.76100000 Y=0.28200000 Z=0.25000000
-2: X=0.23900000 Y=0.71800000 Z=0.75000000
Na2 NPT= 781 R0=0.00010000 RMT= 2.5000 Z: 11.0
LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000
0.0000000 1.0000000 0.0000000
0.0000000 0.0000000 1.0000000
ATOM -3: X=0.25660000 Y=0.27220000 Z=0.12620000
MULT= 8 ISPLIT= 8
-3: X=0.74340000 Y=0.72780000 Z=0.87380000
-3: X=0.25660000 Y=0.27220000 Z=0.37380000
-3: X=0.74340000 Y=0.72780000 Z=0.62620000
-3: X=0.74340000 Y=0.77220000 Z=0.12620000
-3: X=0.25660000 Y=0.22780000 Z=0.87380000
-3: X=0.74340000 Y=0.77220000 Z=0.37380000
-3: X=0.25660000 Y=0.22780000 Z=0.62620000
Nb NPT= 781 R0=0.00010000 RMT= 1.8000 Z: 41.0
LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000
0.0000000 1.0000000 0.0000000
0.0000000 0.0000000 1.0000000
ATOM -4: X=0.30400000 Y=0.25000000 Z=0.00000000
MULT= 4 ISPLIT= 8
-4: X=0.69600000 Y=0.75000000 Z=0.00000000
-4: X=0.30400000 Y=0.25000000 Z=0.50000000
-4: X=0.69600000 Y=0.75000000 Z=0.50000000
O 1 NPT= 781 R0=0.00010000 RMT= 1.4000 Z: 8.0
LOCAL ROT MATRIX: 0.0000000 0.0000000 1.0000000
1.0000000 0.0000000 0.0000000
0.0000000 1.0000000 0.0000000
ATOM -5: X=0.19100000 Y=0.23300000 Z=0.25000000
MULT= 4 ISPLIT= 8
-5: X=0.80900000 Y=0.76700000 Z=0.75000000
-5: X=0.80900000 Y=0.73300000 Z=0.25000000
-5: X=0.19100000 Y=0.26700000 Z=0.75000000
O 2 NPT= 781 R0=0.00010000 RMT= 1.4000 Z: 8.0
LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000
0.0000000 1.0000000 0.0000000
0.0000000 0.0000000 1.0000000
ATOM -6: X=0.53600000 Y=0.03200000 Z=0.14000000
MULT= 8 ISPLIT= 8
-6: X=0.46400000 Y=0.96800000 Z=0.86000000
-6: X=0.53600000 Y=0.03200000 Z=0.36000000
-6: X=0.46400000 Y=0.96800000 Z=0.64000000
-6: X=0.46400000 Y=0.53200000 Z=0.14000000
-6: X=0.53600000 Y=0.46800000 Z=0.86000000
-6: X=0.46400000 Y=0.53200000 Z=0.36000000
-6: X=0.53600000 Y=0.46800000 Z=0.64000000
O 3 NPT= 781 R0=0.00010000 RMT= 1.4000 Z: 8.0
LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000
0.0000000 1.0000000 0.0000000
0.0000000 0.0000000 1.0000000
ATOM -7: X=0.96600000 Y=0.46700000 Z=0.11000000
MULT= 8 ISPLIT= 8
-7: X=0.03400000 Y=0.53300000 Z=0.89000000
-7: X=0.96600000 Y=0.46700000 Z=0.39000000
-7: X=0.03400000 Y=0.53300000 Z=0.61000000
-7: X=0.03400000 Y=0.96700000 Z=0.11000000
-7: X=0.96600000 Y=0.03300000 Z=0.89000000
-7: X=0.03400000 Y=0.96700000 Z=0.39000000
-7: X=0.96600000 Y=0.03300000 Z=0.61000000
O 4 NPT= 781 R0=0.00010000 RMT= 1.4000 Z: 8.0
LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000
0.0000000 1.0000000 0.0000000
0.0000000 0.0000000 1.0000000
8 NUMBER OF SYMMETRY OPERATIONS
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