[Octopus-notify] [oct-run_testsuite on x86_64] daily report - 2006-08-09
Heiko Appel
appel at physik.fu-berlin.de
Wed Aug 9 11:18:56 WEST 2006
Total run-time of the testsuite: 10:13:55
[34m ***** 1D Box ***** [0m
Using workdir : /tmp/octopus.J1pxH4
Using executable : /usr/bin/octopus-intel-9.1-debug
Using test file : /usr/share/octopus/testsuite/finite_systems_1d/04-box_oct_long.test
Using input file : /usr/share/octopus/testsuite/finite_systems_1d/04-box.01-ground_state.inp
Starting test run ...
Executing: cd /tmp/octopus.J1pxH4; /usr/bin/octopus-intel-9.1-debug > out 2>&1
Finished test run.
TotalEnergy : [ [32m OK [0m ]
2th state : [ [32m OK [0m ]
Using input file : /usr/share/octopus/testsuite/finite_systems_1d/04-box.02-oct_long.inp
Starting test run ...
Executing: cd /tmp/octopus.J1pxH4; /usr/bin/octopus-intel-9.1-debug > out 2>&1
Finished test run.
J1 1st iteration : [ [32m OK [0m ]
J1 2nd iteration : [ [32m OK [0m ]
J1 5th iteration : [ [32m OK [0m ]
J1 10th iteration : [ [32m OK [0m ]
J1 15th iteration : [ [32m OK [0m ]
Using input file : /usr/share/octopus/testsuite/finite_systems_1d/04-box.03-oct_long.inp
Starting test run ...
Executing: cd /tmp/octopus.J1pxH4; /usr/bin/octopus-intel-9.1-debug > out 2>&1
Finished test run.
J1 1st iteration : [ [32m OK [0m ]
J1 2nd iteration : [ [32m OK [0m ]
J1 5th iteration : [ [32m OK [0m ]
J1 10th iteration : [ [32m OK [0m ]
J1 15th iteration : [ [32m OK [0m ]
Using input file : /usr/share/octopus/testsuite/finite_systems_1d/04-box.04-oct_long.inp
Starting test run ...
Executing: cd /tmp/octopus.J1pxH4; /usr/bin/octopus-intel-9.1-debug > out 2>&1
Finished test run.
J1 1st iteration : [ [32m OK [0m ]
J1 2nd iteration : [ [32m OK [0m ]
J1 5th iteration : [ [32m OK [0m ]
J1 10th iteration : [ [32m OK [0m ]
J1 15th iteration : [ [32m OK [0m ]
Using input file : /usr/share/octopus/testsuite/finite_systems_1d/04-box.05-oct_local.inp
Starting test run ...
Executing: cd /tmp/octopus.J1pxH4; /usr/bin/octopus-intel-9.1-debug > out 2>&1
Finished test run.
J1 1st iteration : [ [31m FAIL [0m ]
J1 2nd iteration : [ [31m FAIL [0m ]
J1 5th iteration : [ [31m FAIL [0m ]
J1 15th iteration : [ [31m FAIL [0m ]
J1 25th iteration : [ [31m FAIL [0m ]
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This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2, or (at your option)
any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License
along with this program; if not, write to the Free Software
Foundation, Inc., 59 Temple Place - Suite 330, Boston, MA
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Running octopus, version 2.1pre1
build time - Wed Aug 9 00:31:46 CEST 2006
svn revision:
Compiler: ifort
Compiler flags: -static -I/home/appel/opt/intel-9.1/include
The octopus is swimming in n41 (Linux)
Calculation started on 2006/08/09 at 02:38:20
************************** Calculation Mode **************************
Input: [CalculationMode = opt_control]
**********************************************************************
****************************** Species *******************************
Specie "Box1D" is an user-defined potential.
Potential = -5*step(x+5)*step(5-x)
**********************************************************************
Input: [SpinComponents = unpolarized]
Input: [CurvMethod = curv_uniform]
Input: [DerivativesSpace = real_space]
Input: [DerivativesStencil = stencil_star]
************************** Parallelization ***************************
Octopus will run in *serial*
**********************************************************************
******************************** Grid ********************************
Simulation Box:
Type = sphere
Radius [b] = 15.000
The octopus will run in 1 dimension(s).
The octopus will treat the system as periodic in 0 dimension(s).
Main mesh:
Spacing [b] = ( 0.400,-1.000,-1.000) volume/point [b^3] = 0.40000
# inner mesh = 75
# total mesh = 83
Grid Cutoff [H] = 30.843
**********************************************************************
****************************** Hartree *******************************
Input: [PoissonSolver = direct1D]
**********************************************************************
Info: Treating the electrons as non-interacting
Info: Lasers
1:
Polarization: ( 1.0000, 0.0000)( 0.0000, 0.0000)( 0.0000, 0.0000)
Envelope: 0
Frequency: 0.0200 [H]
Amplitude: 0.1000 [H/b]
Intensity: 3.5095E+14 [W/cm^2]
Width: 628.3185 [hbar/H]
Middle t: 628.3185 [hbar/H]
Input: [RelativisticCorrection = non_relativistic]
Input: [TDGauge = length]
Input: [AbsorbingBoundaries = no_absorbing]
Input: [RestartFileFormat = restart_plain]
Input: [MoveIons = static_ions]
Info: FFT allocated with size ( 75, 1, 1) in slot 1
Input: [TDEvolutionMethod = split]
Input: [TDExponentialMethod = standard]
Info: Number of electrons: 1
Input: [SpinComponents = unpolarized]
Input: [SpinComponents = unpolarized]
Input: [SpinComponents = unpolarized]
Input: [SpinComponents = unpolarized]
Input: [SpinComponents = unpolarized]
Input: Fluence of Initial laser 0.81094072
Input: [SpinComponents = unpolarized]
Info: Using Ground State for InitialState
Input: [SpinComponents = unpolarized]
Info: Using Local Target
Info: Starting Optimal Control Run using Scheme: ZR98
Info: Initial forward propagation
Info: Forward propagating Psi
Info: Calculate overlap
=> overlap: 0.23148450
Info: Loop control
Info: Optimal control iteration # 0
=> J1: 0.23148450 J: -2131262.34469746 I: 0.40547036
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.12644429
Info: Loop control
Info: Optimal control iteration # 1
=> J1: 0.12644429 J: 0.07231501 I: 0.02828302
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.21539364
Info: Loop control
Info: Optimal control iteration # 2
=> J1: 0.21539364 J: 0.21392927 I: 0.00038236
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.24096139
Info: Loop control
Info: Optimal control iteration # 3
=> J1: 0.24096139 J: 0.23265111 I: 0.00259726
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.25516115
Info: Loop control
Info: Optimal control iteration # 4
=> J1: 0.25516115 J: 0.24139481 I: 0.00477060
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.26485688
Info: Loop control
Info: Optimal control iteration # 5
=> J1: 0.26485688 J: 0.24693488 I: 0.00657958
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.27214499
Info: Loop control
Info: Optimal control iteration # 6
=> J1: 0.27214499 J: 0.25091164 I: 0.00810688
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.27793065
Info: Loop control
Info: Optimal control iteration # 7
=> J1: 0.27793065 J: 0.25394938 I: 0.00943402
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.28268317
Info: Loop control
Info: Optimal control iteration # 8
=> J1: 0.28268317 J: 0.25635224 I: 0.01061405
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.28667651
Info: Loop control
Info: Optimal control iteration # 9
=> J1: 0.28667651 J: 0.25829418 I: 0.01167971
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.29008516
Info: Loop control
Info: Optimal control iteration # 10
=> J1: 0.29008516 J: 0.25988619 I: 0.01265159
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.29302804
Info: Loop control
Info: Optimal control iteration # 11
=> J1: 0.29302804 J: 0.26120465 I: 0.01354333
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.29559062
Info: Loop control
Info: Optimal control iteration # 12
=> J1: 0.29559062 J: 0.26230493 I: 0.01436450
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.29783698
Info: Loop control
Info: Optimal control iteration # 13
=> J1: 0.29783698 J: 0.26322869 I: 0.01512231
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.29981675
Info: Loop control
Info: Optimal control iteration # 14
=> J1: 0.29981675 J: 0.26400811 I: 0.01582251
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.30156936
Info: Loop control
Info: Optimal control iteration # 15
=> J1: 0.30156936 J: 0.26466854 I: 0.01646992
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.30312678
Info: Loop control
Info: Optimal control iteration # 16
=> J1: 0.30312678 J: 0.26523020 I: 0.01706876
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.30451533
Info: Loop control
Info: Optimal control iteration # 17
=> J1: 0.30451533 J: 0.26570947 I: 0.01762275
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.30575691
Info: Loop control
Info: Optimal control iteration # 18
=> J1: 0.30575691 J: 0.26611967 I: 0.01813530
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.30686999
Info: Loop control
Info: Optimal control iteration # 19
=> J1: 0.30686999 J: 0.26647175 I: 0.01860949
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.30787022
Info: Loop control
Info: Optimal control iteration # 20
=> J1: 0.30787022 J: 0.26677474 I: 0.01904820
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.30877096
Info: Loop control
Info: Optimal control iteration # 21
=> J1: 0.30877096 J: 0.26703614 I: 0.01945405
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.30958372
Info: Loop control
Info: Optimal control iteration # 22
=> J1: 0.30958372 J: 0.26726222 I: 0.01982948
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.31031839
Info: Loop control
Info: Optimal control iteration # 23
=> J1: 0.31031839 J: 0.26745819 I: 0.02017675
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.31098359
Info: Loop control
Info: Optimal control iteration # 24
=> J1: 0.31098359 J: 0.26762845 I: 0.02049796
Info: Propagating backward
Info: Propagating forward
Info: Calculate overlap
=> overlap: 0.31158681
Info: Loop control
Info: Maximum number of iterations reached
Info: Optimal control iteration # 25
=> J1: 0.31158681 J: 0.26777670 I: 0.02079505
Info: Output States
Info: FFT deallocated from slot 1
Calculation ended on 2006/08/09 at 02:43:33
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