Running VASP on 64 cores :
Using executable /home/medea/MD/TaskServer/Tools/vasp6.4.1/Linux-x86_64/vasp_std
running 64 mpi-ranks, on 1 nodes
distrk: each k-point on 64 cores, 1 groups
distr: one band on 1 cores, 64 groups
vasp.6.4.1 05Apr23 (build Apr 16 2023 21:42:41) complex
MD_VERSION_INFO: Compiled 2023-04-16T20:12:19-UTC in mrdevlin:/home/medea/data/
build/vasp6.4.1/19212/x86_64/src/src/build/std from svn 19212
This VASP executable licensed from Materials Design, Inc.
POSCAR found type information on POSCAR CsBiNaClY InAg
POSCAR found : 7 types and 80 ions
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| |
| W W AA RRRRR N N II N N GGGG !!! |
| W W A A R R NN N II NN N G G !!! |
| W W A A R R N N N II N N N G !!! |
| W WW W AAAAAA RRRRR N N N II N N N G GGG ! |
| WW WW A A R R N NN II N NN G G |
| W W A A R R N N II N N GGGG !!! |
| |
| You use a magnetic or noncollinear calculation, but did not specify |
| the initial magnetic moment with the MAGMOM tag. Note that a |
| default of 1 will be used for all atoms. This ferromagnetic setup |
| may break the symmetry of the crystal, in particular it may rule |
| out finding an antiferromagnetic solution. Thence, we recommend |
| setting the initial magnetic moment manually or verifying carefully |
| that this magnetic setup is desired. |
| |
-----------------------------------------------------------------------------
scaLAPACK is switched off
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| |
| W W AA RRRRR N N II N N GGGG !!! |
| W W A A R R NN N II NN N G G !!! |
| W W A A R R N N N II N N N G !!! |
| W WW W AAAAAA RRRRR N N N II N N N G GGG ! |
| WW WW A A R R N NN II N NN G G |
| W W A A R R N N II N N GGGG !!! |
| |
| The value NPAR = 10 specified in the INCAR file was overwritten, |
| because it was not compatible with the 64 processes available: |
| NPAR = 64 |
| was used instead, please check that this makes sense for your |
| machine. |
| |
-----------------------------------------------------------------------------
-----------------------------------------------------------------------------
| |
| W W AA RRRRR N N II N N GGGG !!! |
| W W A A R R NN N II NN N G G !!! |
| W W A A R R N N N II N N N G !!! |
| W WW W AAAAAA RRRRR N N N II N N N G GGG ! |
| WW WW A A R R N NN II N NN G G |
| W W A A R R N N II N N GGGG !!! |
| |
| For optimal performance we recommend to set |
| NCORE = 2 up to number-of-cores-per-socket |
| NCORE specifies how many cores store one orbital (NPAR=cpu/NCORE). |
| This setting can greatly improve the performance of VASP for DFT. |
| The default, NCORE=1 might be grossly inefficient on modern |
| multi-core architectures or massively parallel machines. Do your |
| own testing! More info at https://www.vasp.at/wiki/index.php/NCORE |
| Unfortunately you need to use the default for GW and RPA |
| calculations (for HF NCORE is supported but not extensively tested |
| yet). |
| |
-----------------------------------------------------------------------------
-----------------------------------------------------------------------------
| |
| ----> ADVICE to this user running VASP <---- |
| |
| You have a (more or less) 'large supercell' and for larger cells it |
| might be more efficient to use real-space projection operators. |
| Therefore, try LREAL= Auto in the INCAR file. |
| Mind: For very accurate calculation, you might also keep the |
| reciprocal projection scheme (i.e. LREAL=.FALSE.). |
| |
-----------------------------------------------------------------------------
LDA part: xc-table for Pade appr. of Perdew
-----------------------------------------------------------------------------
| |
| W W AA RRRRR N N II N N GGGG !!! |
| W W A A R R NN N II NN N G G !!! |
| W W A A R R N N N II N N N G !!! |
| W WW W AAAAAA RRRRR N N N II N N N G GGG ! |
| WW WW A A R R N NN II N NN G G |
| W W A A R R N N II N N GGGG !!! |
| |
| The number of bands has been changed from the values supplied in |
| the INCAR file. This is a result of running the parallel version. |
| The orbitals not found in the WAVECAR file will be initialized with |
| random numbers, which is usually adequate. For correlated |
| calculations, however, you should redo the groundstate calculation. |
| I found NBANDS = 573. Now, NBANDS = 576. |
| |
-----------------------------------------------------------------------------
POSCAR, INCAR and KPOINTS ok, starting setup
FFT: planning ... GRIDC
FFT: planning ... GRID_SOFT
FFT: planning ... GRID
WAVECAR not read
charge-density read from file: Cs16Na7Y4AgIn3BiCl48
magnetization density read from file 1
entering main loop
N E dE d eps ncg rms ort
DAV: 1 0.267929403861E+05 0.26793E+05 -0.25403E+05 30528 0.112E+03
DAV: 2 0.218960713032E+05 -0.48969E+04 -0.45571E+04 30528 0.305E+02
DAV: 3 0.209081903517E+05 -0.98788E+03 -0.90405E+03 30528 0.127E+02
DAV: 4 0.206873529549E+05 -0.22084E+03 -0.20691E+03 30528 0.659E+01
DAV: 5 0.206278102484E+05 -0.59543E+02 -0.56158E+02 30528 0.305E+01
gam= 0.000 g(H,U,f)= 0.765E+04 0.556E+04 0.244E+02 ort(H,U,f) = 0.000E+00 0.000E+00 0.000E+00
SDA: 6 0.173907161831E+05 -0.32371E+04 -0.52924E+04 30528 0.132E+05 0.000E+00
gam= 0.382 g(H,U,f)= 0.337E+04 0.430E+04 0.477E+02 ort(H,U,f) = 0.254E+04 0.264E+04 0.178E+02
DMP: 7 0.132809256521E+05 -0.41098E+04 -0.38829E+04 30528 0.772E+04 0.520E+04
gam= 0.382 g(H,U,f)= 0.132E+04 0.343E+03-0.169E+02 ort(H,U,f) =-0.245E+03 0.654E+03-0.119E+02
DMP: 8 0.114320674171E+05 -0.18489E+04 -0.71987E+03 30528 0.165E+04 0.397E+03
gam= 0.382 g(H,U,f)= 0.601E+03 0.411E+02-0.531E-03 ort(H,U,f) = 0.732E+02 0.109E+03 0.156E-02
DMP: 9 0.110732894359E+05 -0.35878E+03 -0.28472E+03 30528 0.642E+03 0.182E+03
gam= 0.382 g(H,U,f)= 0.167E+03 0.121E+02-0.154E-02 ort(H,U,f) = 0.952E+02 0.305E+02-0.833E-03
DMP: 10 0.108924465353E+05 -0.18084E+03 -0.90920E+02 30528 0.179E+03 0.126E+03
gam= 0.382 g(H,U,f)= 0.657E+02 0.614E+01-0.517E-03 ort(H,U,f) =-0.185E+02 0.160E+02-0.843E-03
DMP: 11 0.108284282629E+05 -0.64018E+02 -0.28332E+02 30528 0.718E+02-0.252E+01
gam= 0.382 g(H,U,f)= 0.359E+02 0.328E+01 0.220E-02 ort(H,U,f) = 0.962E+00 0.842E+01 0.483E-02
DMP: 12 0.108144065806E+05 -0.14022E+02 -0.17128E+02 30528 0.392E+02 0.939E+01
gam= 0.382 g(H,U,f)= 0.141E+02 0.159E+01-0.628E-04 ort(H,U,f) = 0.984E+01 0.425E+01-0.475E-02
DMP: 13 0.108148966265E+05 0.49005E+00 -0.84392E+01 30528 0.157E+02 0.141E+02
gam= 0.382 g(H,U,f)= 0.523E+01 0.774E+00 0.120E-03 ort(H,U,f) = 0.500E+01 0.215E+01-0.165E-04
DMP: 14 0.108200428346E+05 0.51462E+01 -0.34946E+01 30528 0.601E+01 0.715E+01
gam= 0.382 g(H,U,f)= 0.258E+01 0.376E+00-0.306E-03 ort(H,U,f) = 0.231E+01 0.109E+01-0.515E-03
DMP: 15 0.108243330571E+05 0.42902E+01 -0.17034E+01 30528 0.296E+01 0.341E+01
gam= 0.382 g(H,U,f)= 0.135E+01 0.189E+00-0.385E-03 ort(H,U,f) = 0.166E+01 0.549E+00-0.475E-03
DMP: 16 0.108265178249E+05 0.21848E+01 -0.95057E+00 30528 0.153E+01 0.220E+01
gam= 0.382 g(H,U,f)= 0.646E+00 0.101E+00 0.321E-04 ort(H,U,f) = 0.107E+01 0.281E+00-0.129E-03
DMP: 17 0.108274275164E+05 0.90969E+00 -0.50442E+00 30528 0.747E+00 0.135E+01
gam= 0.382 g(H,U,f)= 0.371E+00 0.555E-01 0.322E-03 ort(H,U,f) = 0.641E+00 0.149E+00 0.290E-03
DMP: 18 0.108278266328E+05 0.39912E+00 -0.29135E+00 30528 0.426E+00 0.790E+00
gam= 0.382 g(H,U,f)= 0.242E+00 0.322E-01 0.572E-03 ort(H,U,f) = 0.448E+00 0.831E-01 0.623E-03
DMP: 19 0.108280414430E+05 0.21481E+00 -0.19128E+00 30528 0.275E+00 0.532E+00
gam= 0.382 g(H,U,f)= 0.162E+00 0.199E-01 0.882E-03 ort(H,U,f) = 0.330E+00 0.491E-01 0.989E-03
DMP: 20 0.108281958442E+05 0.15440E+00 -0.13104E+00 30528 0.182E+00 0.380E+00
gam= 0.382 g(H,U,f)= 0.115E+00 0.130E-01 0.119E-02 ort(H,U,f) = 0.244E+00 0.307E-01 0.139E-02
DMP: 21 0.108283347111E+05 0.13887E+00 -0.94010E-01 30528 0.130E+00 0.276E+00
gam= 0.382 g(H,U,f)= 0.873E-01 0.883E-02 0.126E-02 ort(H,U,f) = 0.185E+00 0.202E-01 0.159E-02
DMP: 22 0.108284741336E+05 0.13942E+00 -0.70623E-01 30528 0.974E-01 0.207E+00
gam= 0.382 g(H,U,f)= 0.677E-01 0.602E-02 0.815E-03 ort(H,U,f) = 0.144E+00 0.136E-01 0.118E-02
DMP: 23 0.108286158705E+05 0.14174E+00 -0.54105E-01 30528 0.745E-01 0.159E+00
gam= 0.382 g(H,U,f)= 0.536E-01 0.410E-02 0.359E-04 ort(H,U,f) = 0.114E+00 0.922E-02 0.126E-03
DMP: 24 0.108287503925E+05 0.13452E+00 -0.41905E-01 30528 0.578E-01 0.123E+00
gam= 0.382 g(H,U,f)= 0.430E-01 0.279E-02-0.311E-03 ort(H,U,f) = 0.909E-01 0.627E-02-0.642E-03
DMP: 25 0.108288631297E+05 0.11274E+00 -0.32942E-01 30528 0.455E-01 0.965E-01
gam= 0.382 g(H,U,f)= 0.349E-01 0.191E-02-0.155E-03 ort(H,U,f) = 0.734E-01 0.429E-02-0.499E-03
DMP: 26 0.108289465925E+05 0.83463E-01 -0.26453E-01 30528 0.367E-01 0.772E-01
gam= 0.382 g(H,U,f)= 0.287E-01 0.132E-02-0.244E-04 ort(H,U,f) = 0.598E-01 0.295E-02-0.125E-03
DMP: 27 0.108290036437E+05 0.57051E-01 -0.21557E-01 30528 0.300E-01 0.627E-01
gam= 0.382 g(H,U,f)= 0.238E-01 0.921E-03-0.869E-05 ort(H,U,f) = 0.493E-01 0.204E-02 0.763E-05
DMP: 28 0.108290411767E+05 0.37533E-01 -0.17709E-01 30528 0.247E-01 0.513E-01
gam= 0.382 g(H,U,f)= 0.199E-01 0.647E-03-0.122E-04 ort(H,U,f) = 0.409E-01 0.143E-02 0.518E-05
DMP: 29 0.108290648353E+05 0.23659E-01 -0.14668E-01 30528 0.205E-01 0.423E-01
gam= 0.382 g(H,U,f)= 0.167E-01 0.461E-03-0.816E-05 ort(H,U,f) = 0.342E-01 0.101E-02-0.690E-05
DMP: 30 0.108290788016E+05 0.13966E-01 -0.12256E-01 30528 0.172E-01 0.352E-01
gam= 0.382 g(H,U,f)= 0.142E-01 0.332E-03-0.312E-05 ort(H,U,f) = 0.289E-01 0.718E-03-0.630E-05
DMP: 31 0.108290865812E+05 0.77796E-02 -0.10323E-01 30528 0.145E-01 0.296E-01
gam= 0.382 g(H,U,f)= 0.121E-01 0.243E-03-0.667E-06 ort(H,U,f) = 0.245E-01 0.519E-03-0.244E-05
DMP: 32 0.108290903520E+05 0.37708E-02 -0.87545E-02 30528 0.123E-01 0.250E-01
gam= 0.382 g(H,U,f)= 0.104E-01 0.180E-03-0.463E-07 ort(H,U,f) = 0.209E-01 0.380E-03-0.364E-06
DMP: 33 0.108290913830E+05 0.10310E-02 -0.74761E-02 30528 0.106E-01 0.213E-01
gam= 0.382 g(H,U,f)= 0.913E-02 0.135E-03-0.188E-07 ort(H,U,f) = 0.179E-01 0.281E-03 0.105E-06
DMP: 34 0.108290907821E+05 -0.60086E-03 -0.64897E-02 30528 0.926E-02 0.182E-01
gam= 0.382 g(H,U,f)= 0.843E-02 0.102E-03-0.452E-07 ort(H,U,f) = 0.156E-01 0.211E-03 0.461E-07
DMP: 35 0.108290890596E+05 -0.17225E-02 -0.58359E-02 30528 0.853E-02 0.159E-01
gam= 0.382 g(H,U,f)= 0.800E-02 0.792E-04-0.350E-07 ort(H,U,f) = 0.141E-01 0.161E-03-0.232E-07
DMP: 36 0.108290863968E+05 -0.26629E-02 -0.54138E-02 30528 0.808E-02 0.143E-01
gam= 0.382 g(H,U,f)= 0.765E-02 0.629E-04-0.154E-07 ort(H,U,f) = 0.131E-01 0.125E-03-0.288E-07
DMP: 37 0.108290827885E+05 -0.36082E-02 -0.51124E-02 30528 0.771E-02 0.133E-01
gam= 0.382 g(H,U,f)= 0.732E-02 0.513E-04-0.411E-08 ort(H,U,f) = 0.124E-01 0.100E-03-0.134E-07
DMP: 38 0.108290784806E+05 -0.43079E-02 -0.48625E-02 30528 0.737E-02 0.125E-01
gam= 0.382 g(H,U,f)= 0.696E-02 0.429E-04-0.631E-09 ort(H,U,f) = 0.118E-01 0.818E-04-0.318E-08
DMP: 39 0.108290735129E+05 -0.49677E-02 -0.46228E-02 30528 0.700E-02 0.119E-01
gam= 0.382 g(H,U,f)= 0.664E-02 0.367E-04-0.194E-09 ort(H,U,f) = 0.113E-01 0.686E-04-0.189E-09
DMP: 40 0.108290682033E+05 -0.53097E-02 -0.44035E-02 30528 0.668E-02 0.113E-01
gam= 0.382 g(H,U,f)= 0.630E-02 0.320E-04-0.245E-09 ort(H,U,f) = 0.107E-01 0.587E-04-0.582E-10
DMP: 41 0.108290625990E+05 -0.56043E-02 -0.41815E-02 30528 0.633E-02 0.108E-01
gam= 0.382 g(H,U,f)= 0.599E-02 0.283E-04-0.221E-09 ort(H,U,f) = 0.102E-01 0.512E-04-0.264E-09
DMP: 42 0.108290568885E+05 -0.57105E-02 -0.39723E-02 30528 0.601E-02 0.103E-01
gam= 0.382 g(H,U,f)= 0.569E-02 0.254E-04-0.183E-09 ort(H,U,f) = 0.970E-02 0.454E-04-0.300E-09
DMP: 43 0.108290511363E+05 -0.57523E-02 -0.37743E-02 30528 0.571E-02 0.974E-02
gam= 0.382 g(H,U,f)= 0.539E-02 0.229E-04-0.185E-09 ort(H,U,f) = 0.922E-02 0.406E-04-0.285E-09
DMP: 44 0.108290454012E+05 -0.57351E-02 -0.35811E-02 30528 0.542E-02 0.926E-02
gam= 0.382 g(H,U,f)= 0.514E-02 0.209E-04-0.211E-09 ort(H,U,f) = 0.875E-02 0.367E-04-0.301E-09
DMP: 45 0.108290397380E+05 -0.56631E-02 -0.34061E-02 30528 0.516E-02 0.879E-02
gam= 0.382 g(H,U,f)= 0.488E-02 0.191E-04-0.235E-09 ort(H,U,f) = 0.832E-02 0.334E-04-0.340E-09
DMP: 46 0.108290341543E+05 -0.55838E-02 -0.32370E-02 30528 0.490E-02 0.836E-02
gam= 0.382 g(H,U,f)= 0.466E-02 0.175E-04-0.246E-09 ort(H,U,f) = 0.791E-02 0.305E-04-0.373E-09
DMP: 47 0.108290286809E+05 -0.54733E-02 -0.30851E-02 30528 0.468E-02 0.794E-02
gam= 0.382 g(H,U,f)= 0.445E-02 0.161E-04-0.247E-09 ort(H,U,f) = 0.754E-02 0.280E-04-0.390E-09
DMP: 48 0.108290233120E+05 -0.53690E-02 -0.29445E-02 30528 0.447E-02 0.757E-02
gam= 0.382 g(H,U,f)= 0.426E-02 0.149E-04-0.240E-09 ort(H,U,f) = 0.720E-02 0.258E-04-0.391E-09
DMP: 49 0.108290180492E+05 -0.52627E-02 -0.28122E-02 30528 0.427E-02 0.723E-02
gam= 0.382 g(H,U,f)= 0.408E-02 0.138E-04-0.231E-09 ort(H,U,f) = 0.688E-02 0.239E-04-0.382E-09
DMP: 50 0.108290128985E+05 -0.51507E-02 -0.26914E-02 30528 0.409E-02 0.690E-02
gam= 0.382 g(H,U,f)= 0.391E-02 0.129E-04-0.220E-09 ort(H,U,f) = 0.658E-02 0.222E-04-0.368E-09
DMP: 51 0.108290078504E+05 -0.50481E-02 -0.25785E-02 30528 0.392E-02 0.661E-02
gam= 0.382 g(H,U,f)= 0.376E-02 0.120E-04-0.209E-09 ort(H,U,f) = 0.631E-02 0.207E-04-0.352E-09
DMP: 52 0.108290029057E+05 -0.49447E-02 -0.24738E-02 30528 0.377E-02 0.633E-02
gam= 0.382 g(H,U,f)= 0.361E-02 0.113E-04-0.198E-09 ort(H,U,f) = 0.605E-02 0.193E-04-0.335E-09
DMP: 53 0.108289980577E+05 -0.48480E-02 -0.23764E-02 30528 0.362E-02 0.607E-02
gam= 0.382 g(H,U,f)= 0.347E-02 0.106E-04-0.188E-09 ort(H,U,f) = 0.581E-02 0.181E-04-0.318E-09
DMP: 54 0.108289933030E+05 -0.47546E-02 -0.22839E-02 30528 0.348E-02 0.583E-02
gam= 0.382 g(H,U,f)= 0.334E-02 0.995E-05-0.178E-09 ort(H,U,f) = 0.559E-02 0.170E-04-0.302E-09
DMP: 55 0.108289886407E+05 -0.46624E-02 -0.21960E-02 30528 0.335E-02 0.561E-02
gam= 0.382 g(H,U,f)= 0.321E-02 0.939E-05-0.169E-09 ort(H,U,f) = 0.537E-02 0.160E-04-0.286E-09
DMP: 56 0.108289840699E+05 -0.45708E-02 -0.21126E-02 30528 0.322E-02 0.539E-02
gam= 0.382 g(H,U,f)= 0.309E-02 0.887E-05-0.160E-09 ort(H,U,f) = 0.517E-02 0.151E-04-0.271E-09
DMP: 57 0.108289795899E+05 -0.44800E-02 -0.20333E-02 30528 0.310E-02 0.519E-02
gam= 0.382 g(H,U,f)= 0.298E-02 0.840E-05-0.151E-09 ort(H,U,f) = 0.498E-02 0.142E-04-0.256E-09
DMP: 58 0.108289751997E+05 -0.43902E-02 -0.19578E-02 30528 0.299E-02 0.499E-02
gam= 0.382 g(H,U,f)= 0.287E-02 0.795E-05-0.142E-09 ort(H,U,f) = 0.479E-02 0.135E-04-0.242E-09
DMP: 59 0.108289708988E+05 -0.43009E-02 -0.18853E-02 30528 0.288E-02 0.481E-02
gam= 0.382 g(H,U,f)= 0.276E-02 0.754E-05-0.134E-09 ort(H,U,f) = 0.462E-02 0.128E-04-0.228E-09
DMP: 60 0.108289666876E+05 -0.42112E-02 -0.18159E-02 30528 0.277E-02 0.463E-02
gam= 0.382 g(H,U,f)= 0.266E-02 0.715E-05-0.127E-09 ort(H,U,f) = 0.445E-02 0.121E-04-0.216E-09
DMP: 61 0.108289625658E+05 -0.41218E-02 -0.17499E-02 30528 0.267E-02 0.446E-02
gam= 0.382 g(H,U,f)= 0.257E-02 0.679E-05-0.120E-09 ort(H,U,f) = 0.429E-02 0.115E-04-0.204E-09
DMP: 62 0.108289585326E+05 -0.40333E-02 -0.16871E-02 30528 0.258E-02 0.430E-02
gam= 0.382 g(H,U,f)= 0.248E-02 0.645E-05-0.113E-09 ort(H,U,f) = 0.414E-02 0.109E-04-0.192E-09
DMP: 63 0.108289545862E+05 -0.39463E-02 -0.16275E-02 30528 0.248E-02 0.415E-02
gam= 0.382 g(H,U,f)= 0.239E-02 0.614E-05-0.107E-09 ort(H,U,f) = 0.399E-02 0.104E-04-0.182E-09
DMP: 64 0.108289507246E+05 -0.38616E-02 -0.15708E-02 30528 0.240E-02 0.400E-02
gam= 0.382 g(H,U,f)= 0.231E-02 0.584E-05-0.102E-09 ort(H,U,f) = 0.385E-02 0.985E-05-0.172E-09
DMP: 65 0.108289469452E+05 -0.37794E-02 -0.15170E-02 30528 0.232E-02 0.386E-02
gam= 0.382 g(H,U,f)= 0.223E-02 0.556E-05-0.963E-10 ort(H,U,f) = 0.372E-02 0.937E-05-0.163E-09
DMP: 66 0.108289432452E+05 -0.37000E-02 -0.14655E-02 30528 0.224E-02 0.373E-02
gam= 0.382 g(H,U,f)= 0.216E-02 0.530E-05-0.914E-10 ort(H,U,f) = 0.359E-02 0.893E-05-0.155E-09
DMP: 67 0.108289396222E+05 -0.36230E-02 -0.14163E-02 30528 0.216E-02 0.360E-02
gam= 0.382 g(H,U,f)= 0.209E-02 0.506E-05-0.868E-10 ort(H,U,f) = 0.347E-02 0.851E-05-0.147E-09
DMP: 68 0.108289360737E+05 -0.35484E-02 -0.13692E-02 30528 0.209E-02 0.348E-02
gam= 0.382 g(H,U,f)= 0.202E-02 0.483E-05-0.825E-10 ort(H,U,f) = 0.336E-02 0.812E-05-0.139E-09
DMP: 69 0.108289325977E+05 -0.34760E-02 -0.13239E-02 30528 0.202E-02 0.337E-02
gam= 0.382 g(H,U,f)= 0.195E-02 0.461E-05-0.784E-10 ort(H,U,f) = 0.325E-02 0.776E-05-0.132E-09
DMP: 70 0.108289291924E+05 -0.34053E-02 -0.12804E-02 30528 0.196E-02 0.326E-02
gam= 0.382 g(H,U,f)= 0.189E-02 0.441E-05-0.747E-10 ort(H,U,f) = 0.314E-02 0.741E-05-0.126E-09
DMP: 71 0.108289258562E+05 -0.33362E-02 -0.12388E-02 30528 0.189E-02 0.315E-02
gam= 0.382 g(H,U,f)= 0.183E-02 0.422E-05-0.712E-10 ort(H,U,f) = 0.304E-02 0.708E-05-0.120E-09
DMP: 72 0.108289225875E+05 -0.32687E-02 -0.11989E-02 30528 0.183E-02 0.305E-02
gam= 0.382 g(H,U,f)= 0.177E-02 0.403E-05-0.680E-10 ort(H,U,f) = 0.294E-02 0.677E-05-0.114E-09
DMP: 73 0.108289193849E+05 -0.32027E-02 -0.11605E-02 30528 0.177E-02 0.295E-02
gam= 0.382 g(H,U,f)= 0.171E-02 0.386E-05-0.650E-10 ort(H,U,f) = 0.285E-02 0.648E-05-0.109E-09
DMP: 74 0.108289162470E+05 -0.31378E-02 -0.11236E-02 30528 0.172E-02 0.286E-02
gam= 0.382 g(H,U,f)= 0.166E-02 0.370E-05-0.624E-10 ort(H,U,f) = 0.276E-02 0.621E-05-0.105E-09
DMP: 75 0.108289131729E+05 -0.30741E-02 -0.10879E-02 30528 0.166E-02 0.277E-02
gam= 0.382 g(H,U,f)= 0.161E-02 0.354E-05-0.599E-10 ort(H,U,f) = 0.267E-02 0.595E-05-0.100E-09
DMP: 76 0.108289101618E+05 -0.30111E-02 -0.10534E-02 30528 0.161E-02 0.268E-02
gam= 0.382 g(H,U,f)= 0.156E-02 0.340E-05-0.577E-10 ort(H,U,f) = 0.259E-02 0.570E-05-0.965E-10
DMP: 77 0.108289072130E+05 -0.29488E-02 -0.10202E-02 30528 0.156E-02 0.259E-02
gam= 0.382 g(H,U,f)= 0.151E-02 0.326E-05-0.555E-10 ort(H,U,f) = 0.251E-02 0.546E-05-0.928E-10
DMP: 78 0.108289043253E+05 -0.28877E-02 -0.98814E-03 30528 0.151E-02 0.251E-02
gam= 0.382 g(H,U,f)= 0.146E-02 0.312E-05-0.533E-10 ort(H,U,f) = 0.243E-02 0.523E-05-0.892E-10
DMP: 79 0.108289014971E+05 -0.28281E-02 -0.95730E-03 30528 0.146E-02 0.243E-02
gam= 0.382 g(H,U,f)= 0.142E-02 0.299E-05-0.512E-10 ort(H,U,f) = 0.235E-02 0.502E-05-0.856E-10
DMP: 80 0.108288987270E+05 -0.27701E-02 -0.92768E-03 30528 0.142E-02 0.236E-02
gam= 0.382 g(H,U,f)= 0.137E-02 0.287E-05-0.491E-10 ort(H,U,f) = 0.228E-02 0.481E-05-0.822E-10
DMP: 81 0.108288960131E+05 -0.27139E-02 -0.89933E-03 30528 0.138E-02 0.228E-02
gam= 0.382 g(H,U,f)= 0.133E-02 0.275E-05-0.471E-10 ort(H,U,f) = 0.221E-02 0.461E-05-0.789E-10
DMP: 82 0.108288933536E+05 -0.26595E-02 -0.87217E-03 30528 0.133E-02 0.221E-02
gam= 0.382 g(H,U,f)= 0.129E-02 0.264E-05-0.451E-10 ort(H,U,f) = 0.214E-02 0.443E-05-0.756E-10
DMP: 83 0.108288907465E+05 -0.26071E-02 -0.84617E-03 30528 0.130E-02 0.215E-02
gam= 0.382 g(H,U,f)= 0.125E-02 0.254E-05-0.433E-10 ort(H,U,f) = 0.208E-02 0.425E-05-0.725E-10
DMP: 84 0.108288881901E+05 -0.25564E-02 -0.82116E-03 30528 0.126E-02 0.208E-02
gam= 0.382 g(H,U,f)= 0.122E-02 0.244E-05-0.415E-10 ort(H,U,f) = 0.202E-02 0.408E-05-0.695E-10
DMP: 85 0.108288856827E+05 -0.25074E-02 -0.79697E-03 30528 0.122E-02 0.202E-02
gam= 0.382 g(H,U,f)= 0.118E-02 0.235E-05-0.398E-10 ort(H,U,f) = 0.196E-02 0.392E-05-0.667E-10
DMP: 86 0.108288832232E+05 -0.24595E-02 -0.77349E-03 30528 0.118E-02 0.196E-02
gam= 0.382 g(H,U,f)= 0.115E-02 0.226E-05-0.382E-10 ort(H,U,f) = 0.190E-02 0.377E-05-0.640E-10
DMP: 87 0.108288808108E+05 -0.24125E-02 -0.75065E-03 30528 0.115E-02 0.190E-02
gam= 0.382 g(H,U,f)= 0.111E-02 0.217E-05-0.367E-10 ort(H,U,f) = 0.185E-02 0.363E-05-0.615E-10
DMP: 88 0.108288784447E+05 -0.23661E-02 -0.72842E-03 30528 0.111E-02 0.185E-02
gam= 0.382 g(H,U,f)= 0.108E-02 0.209E-05-0.353E-10 ort(H,U,f) = 0.179E-02 0.349E-05-0.591E-10
DMP: 89 0.108288761244E+05 -0.23203E-02 -0.70674E-03 30528 0.108E-02 0.179E-02
gam= 0.382 g(H,U,f)= 0.105E-02 0.201E-05-0.339E-10 ort(H,U,f) = 0.174E-02 0.336E-05-0.568E-10
DMP: 90 0.108288738494E+05 -0.22750E-02 -0.68560E-03 30528 0.105E-02 0.174E-02
gam= 0.382 g(H,U,f)= 0.102E-02 0.193E-05-0.326E-10 ort(H,U,f) = 0.169E-02 0.323E-05-0.546E-10
DMP: 91 0.108288716193E+05 -0.22301E-02 -0.66502E-03 30528 0.102E-02 0.169E-02
gam= 0.382 g(H,U,f)= 0.985E-03 0.186E-05-0.314E-10 ort(H,U,f) = 0.163E-02 0.311E-05-0.525E-10
DMP: 92 0.108288694333E+05 -0.21859E-02 -0.64498E-03 30528 0.987E-03 0.164E-02
gam= 0.382 g(H,U,f)= 0.955E-03 0.179E-05-0.302E-10 ort(H,U,f) = 0.159E-02 0.299E-05-0.504E-10
DMP: 93 0.108288672910E+05 -0.21424E-02 -0.62558E-03 30528 0.957E-03 0.159E-02
gam= 0.382 g(H,U,f)= 0.927E-03 0.172E-05-0.290E-10 ort(H,U,f) = 0.154E-02 0.287E-05-0.485E-10
DMP: 94 0.108288651913E+05 -0.20997E-02 -0.60679E-03 30528 0.928E-03 0.154E-02
gam= 0.382 g(H,U,f)= 0.899E-03 0.165E-05-0.279E-10 ort(H,U,f) = 0.149E-02 0.276E-05-0.466E-10
DMP: 95 0.108288631333E+05 -0.20579E-02 -0.58864E-03 30528 0.901E-03 0.149E-02
gam= 0.382 g(H,U,f)= 0.872E-03 0.159E-05-0.268E-10 ort(H,U,f) = 0.145E-02 0.266E-05-0.448E-10
DMP: 96 0.108288611160E+05 -0.20174E-02 -0.57114E-03 30528 0.874E-03 0.145E-02
gam= 0.382 g(H,U,f)= 0.847E-03 0.153E-05-0.257E-10 ort(H,U,f) = 0.140E-02 0.255E-05-0.430E-10
DMP: 97 0.108288591380E+05 -0.19780E-02 -0.55425E-03 30528 0.848E-03 0.141E-02
gam= 0.382 g(H,U,f)= 0.822E-03 0.147E-05-0.246E-10 ort(H,U,f) = 0.136E-02 0.246E-05-0.413E-10
DMP: 98 0.108288571983E+05 -0.19397E-02 -0.53791E-03 30528 0.823E-03 0.137E-02
gam= 0.382 g(H,U,f)= 0.798E-03 0.141E-05-0.236E-10 ort(H,U,f) = 0.132E-02 0.236E-05-0.396E-10
DMP: 99 0.108288552959E+05 -0.19024E-02 -0.52209E-03 30528 0.799E-03 0.133E-02
gam= 0.382 g(H,U,f)= 0.774E-03 0.136E-05-0.226E-10 ort(H,U,f) = 0.128E-02 0.227E-05-0.379E-10
DMP: 100 0.108288534299E+05 -0.18660E-02 -0.50675E-03 30528 0.776E-03 0.129E-02
gam= 0.382 g(H,U,f)= 0.752E-03 0.131E-05-0.217E-10 ort(H,U,f) = 0.125E-02 0.219E-05-0.364E-10
DMP: 101 0.108288515994E+05 -0.18304E-02 -0.49187E-03 30528 0.753E-03 0.125E-02
gam= 0.382 g(H,U,f)= 0.729E-03 0.126E-05-0.208E-10 ort(H,U,f) = 0.121E-02 0.210E-05-0.349E-10
DMP: 102 0.108288498039E+05 -0.17956E-02 -0.47743E-03 30528 0.731E-03 0.121E-02
gam= 0.382 g(H,U,f)= 0.708E-03 0.121E-05-0.200E-10 ort(H,U,f) = 0.117E-02 0.202E-05-0.334E-10
DMP: 103 0.108288480425E+05 -0.17614E-02 -0.46341E-03 30528 0.709E-03 0.118E-02
gam= 0.382 g(H,U,f)= 0.687E-03 0.117E-05-0.192E-10 ort(H,U,f) = 0.114E-02 0.195E-05-0.321E-10
DMP: 104 0.108288463147E+05 -0.17278E-02 -0.44979E-03 30528 0.688E-03 0.114E-02
gam= 0.382 g(H,U,f)= 0.667E-03 0.112E-05-0.184E-10 ort(H,U,f) = 0.111E-02 0.188E-05-0.308E-10
DMP: 105 0.108288446199E+05 -0.16948E-02 -0.43655E-03 30528 0.668E-03 0.111E-02
gam= 0.382 g(H,U,f)= 0.647E-03 0.108E-05-0.176E-10 ort(H,U,f) = 0.107E-02 0.180E-05-0.295E-10
DMP: 106 0.108288429575E+05 -0.16624E-02 -0.42368E-03 30528 0.648E-03 0.108E-02
gam= 0.382 g(H,U,f)= 0.628E-03 0.104E-05-0.169E-10 ort(H,U,f) = 0.104E-02 0.174E-05-0.283E-10
DMP: 107 0.108288413269E+05 -0.16306E-02 -0.41122E-03 30528 0.629E-03 0.104E-02
gam= 0.382 g(H,U,f)= 0.610E-03 0.100E-05-0.162E-10 ort(H,U,f) = 0.101E-02 0.167E-05-0.271E-10
DMP: 108 0.108288397275E+05 -0.15994E-02 -0.39915E-03 30528 0.611E-03 0.101E-02
gam= 0.382 g(H,U,f)= 0.592E-03 0.964E-06-0.155E-10 ort(H,U,f) = 0.982E-03 0.161E-05-0.260E-10
DMP: 109 0.108288381585E+05 -0.15690E-02 -0.38747E-03 30528 0.593E-03 0.983E-03
gam= 0.382 g(H,U,f)= 0.575E-03 0.928E-06-0.148E-10 ort(H,U,f) = 0.953E-03 0.155E-05-0.249E-10
DMP: 110 0.108288366191E+05 -0.15393E-02 -0.37619E-03 30528 0.576E-03 0.955E-03
gam= 0.382 g(H,U,f)= 0.558E-03 0.893E-06-0.142E-10 ort(H,U,f) = 0.925E-03 0.149E-05-0.238E-10
DMP: 111 0.108288351087E+05 -0.15104E-02 -0.36529E-03 30528 0.559E-03 0.927E-03
gam= 0.382 g(H,U,f)= 0.542E-03 0.860E-06-0.136E-10 ort(H,U,f) = 0.899E-03 0.144E-05-0.228E-10
DMP: 112 0.108288336265E+05 -0.14823E-02 -0.35474E-03 30528 0.543E-03 0.900E-03
gam= 0.382 g(H,U,f)= 0.527E-03 0.829E-06-0.130E-10 ort(H,U,f) = 0.873E-03 0.138E-05-0.218E-10
DMP: 113 0.108288321717E+05 -0.14547E-02 -0.34451E-03 30528 0.527E-03 0.874E-03
gam= 0.382 g(H,U,f)= 0.511E-03 0.799E-06-0.125E-10 ort(H,U,f) = 0.848E-03 0.133E-05-0.209E-10
DMP: 114 0.108288307439E+05 -0.14278E-02 -0.33459E-03 30528 0.512E-03 0.849E-03
gam= 0.382 g(H,U,f)= 0.497E-03 0.770E-06-0.119E-10 ort(H,U,f) = 0.823E-03 0.128E-05-0.200E-10
DMP: 115 0.108288293425E+05 -0.14015E-02 -0.32499E-03 30528 0.498E-03 0.824E-03
gam= 0.382 g(H,U,f)= 0.483E-03 0.742E-06-0.115E-10 ort(H,U,f) = 0.799E-03 0.124E-05-0.192E-10
DMP: 116 0.108288279667E+05 -0.13758E-02 -0.31570E-03 30528 0.483E-03 0.801E-03
gam= 0.382 g(H,U,f)= 0.469E-03 0.715E-06-0.110E-10 ort(H,U,f) = 0.777E-03 0.119E-05-0.184E-10
DMP: 117 0.108288266158E+05 -0.13508E-02 -0.30670E-03 30528 0.470E-03 0.778E-03
gam= 0.382 g(H,U,f)= 0.456E-03 0.689E-06-0.105E-10 ort(H,U,f) = 0.755E-03 0.115E-05-0.176E-10
DMP: 118 0.108288252893E+05 -0.13265E-02 -0.29797E-03 30528 0.456E-03 0.756E-03
gam= 0.382 g(H,U,f)= 0.443E-03 0.665E-06-0.101E-10 ort(H,U,f) = 0.733E-03 0.111E-05-0.169E-10
DMP: 119 0.108288239866E+05 -0.13027E-02 -0.28950E-03 30528 0.443E-03 0.734E-03
gam= 0.382 g(H,U,f)= 0.430E-03 0.641E-06-0.967E-11 ort(H,U,f) = 0.712E-03 0.107E-05-0.162E-10
DMP: 120 0.108288227073E+05 -0.12794E-02 -0.28127E-03 30528 0.431E-03 0.713E-03
gam= 0.382 g(H,U,f)= 0.418E-03 0.618E-06-0.927E-11 ort(H,U,f) = 0.692E-03 0.103E-05-0.155E-10
DMP: 121 0.108288214508E+05 -0.12565E-02 -0.27327E-03 30528 0.418E-03 0.693E-03
gam= 0.382 g(H,U,f)= 0.406E-03 0.597E-06-0.888E-11 ort(H,U,f) = 0.672E-03 0.995E-06-0.149E-10
DMP: 122 0.108288202166E+05 -0.12341E-02 -0.26548E-03 30528 0.407E-03 0.673E-03
gam= 0.382 g(H,U,f)= 0.394E-03 0.576E-06-0.851E-11 ort(H,U,f) = 0.653E-03 0.960E-06-0.143E-10
DMP: 123 0.108288190045E+05 -0.12121E-02 -0.25790E-03 30528 0.395E-03 0.654E-03
gam= 0.382 g(H,U,f)= 0.383E-03 0.555E-06-0.815E-11 ort(H,U,f) = 0.634E-03 0.926E-06-0.137E-10
DMP: 124 0.108288178140E+05 -0.11905E-02 -0.25051E-03 30528 0.384E-03 0.635E-03
gam= 0.382 g(H,U,f)= 0.372E-03 0.536E-06-0.781E-11 ort(H,U,f) = 0.616E-03 0.893E-06-0.131E-10
DMP: 125 0.108288166449E+05 -0.11692E-02 -0.24333E-03 30528 0.373E-03 0.617E-03
gam= 0.382 g(H,U,f)= 0.361E-03 0.517E-06-0.748E-11 ort(H,U,f) = 0.599E-03 0.862E-06-0.125E-10
DMP: 126 0.108288154966E+05 -0.11482E-02 -0.23635E-03 30528 0.362E-03 0.600E-03
gam= 0.382 g(H,U,f)= 0.351E-03 0.499E-06-0.716E-11 ort(H,U,f) = 0.581E-03 0.831E-06-0.120E-10
DMP: 127 0.108288143691E+05 -0.11276E-02 -0.22957E-03 30528 0.352E-03 0.582E-03
gam= 0.382 g(H,U,f)= 0.341E-03 0.481E-06-0.687E-11 ort(H,U,f) = 0.565E-03 0.802E-06-0.115E-10
DMP: 128 0.108288132618E+05 -0.11073E-02 -0.22299E-03 30528 0.341E-03 0.566E-03
gam= 0.382 g(H,U,f)= 0.331E-03 0.464E-06-0.658E-11 ort(H,U,f) = 0.549E-03 0.773E-06-0.110E-10
DMP: 129 0.108288121744E+05 -0.10874E-02 -0.21662E-03 30528 0.332E-03 0.549E-03
gam= 0.382 g(H,U,f)= 0.322E-03 0.447E-06-0.631E-11 ort(H,U,f) = 0.533E-03 0.746E-06-0.106E-10
DMP: 130 0.108288111065E+05 -0.10679E-02 -0.21044E-03 30528 0.322E-03 0.534E-03
gam= 0.382 g(H,U,f)= 0.313E-03 0.432E-06-0.604E-11 ort(H,U,f) = 0.518E-03 0.720E-06-0.101E-10
DMP: 131 0.108288100575E+05 -0.10490E-02 -0.20446E-03 30528 0.313E-03 0.518E-03
gam= 0.382 g(H,U,f)= 0.304E-03 0.417E-06-0.579E-11 ort(H,U,f) = 0.503E-03 0.694E-06-0.971E-11
DMP: 132 0.108288090270E+05 -0.10305E-02 -0.19867E-03 30528 0.304E-03 0.504E-03
gam= 0.382 g(H,U,f)= 0.295E-03 0.402E-06-0.555E-11 ort(H,U,f) = 0.489E-03 0.670E-06-0.930E-11
DMP: 133 0.108288080145E+05 -0.10125E-02 -0.19305E-03 30528 0.296E-03 0.489E-03
gam= 0.382 g(H,U,f)= 0.287E-03 0.388E-06-0.532E-11 ort(H,U,f) = 0.475E-03 0.647E-06-0.891E-11
DMP: 134 0.108288070196E+05 -0.99487E-03 -0.18759E-03 30528 0.287E-03 0.476E-03
gam= 0.382 g(H,U,f)= 0.279E-03 0.375E-06-0.510E-11 ort(H,U,f) = 0.462E-03 0.624E-06-0.854E-11
DMP: 135 0.108288060421E+05 -0.97759E-03 -0.18229E-03 30528 0.279E-03 0.462E-03
gam= 0.382 g(H,U,f)= 0.271E-03 0.362E-06-0.489E-11 ort(H,U,f) = 0.448E-03 0.603E-06-0.819E-11
DMP: 136 0.108288050814E+05 -0.96065E-03 -0.17714E-03 30528 0.271E-03 0.449E-03
gam= 0.382 g(H,U,f)= 0.263E-03 0.349E-06-0.468E-11 ort(H,U,f) = 0.436E-03 0.582E-06-0.785E-11
DMP: 137 0.108288041374E+05 -0.94404E-03 -0.17213E-03 30528 0.264E-03 0.436E-03
gam= 0.382 g(H,U,f)= 0.256E-03 0.337E-06-0.449E-11 ort(H,U,f) = 0.423E-03 0.562E-06-0.752E-11
DMP: 138 0.108288032096E+05 -0.92776E-03 -0.16726E-03 30528 0.256E-03 0.424E-03
gam= 0.382 g(H,U,f)= 0.249E-03 0.326E-06-0.430E-11 ort(H,U,f) = 0.411E-03 0.542E-06-0.721E-11
DMP: 139 0.108288022978E+05 -0.91177E-03 -0.16252E-03 30528 0.249E-03 0.412E-03
gam= 0.382 g(H,U,f)= 0.242E-03 0.314E-06-0.412E-11 ort(H,U,f) = 0.400E-03 0.524E-06-0.690E-11
DMP: 140 0.108288014018E+05 -0.89604E-03 -0.15791E-03 30528 0.242E-03 0.400E-03
gam= 0.382 g(H,U,f)= 0.235E-03 0.304E-06-0.394E-11 ort(H,U,f) = 0.388E-03 0.506E-06-0.661E-11
DMP: 141 0.108288005212E+05 -0.88055E-03 -0.15342E-03 30528 0.235E-03 0.389E-03
gam= 0.382 g(H,U,f)= 0.228E-03 0.293E-06-0.378E-11 ort(H,U,f) = 0.377E-03 0.488E-06-0.633E-11
DMP: 142 0.108287996560E+05 -0.86528E-03 -0.14906E-03 30528 0.228E-03 0.378E-03
gam= 0.382 g(H,U,f)= 0.222E-03 0.283E-06-0.362E-11 ort(H,U,f) = 0.367E-03 0.472E-06-0.607E-11
DMP: 143 0.108287988057E+05 -0.85029E-03 -0.14483E-03 30528 0.222E-03 0.367E-03
gam= 0.382 g(H,U,f)= 0.215E-03 0.273E-06-0.347E-11 ort(H,U,f) = 0.356E-03 0.455E-06-0.582E-11
DMP: 144 0.108287979700E+05 -0.83563E-03 -0.14072E-03 30528 0.216E-03 0.357E-03
gam= 0.382 g(H,U,f)= 0.209E-03 0.264E-06-0.333E-11 ort(H,U,f) = 0.346E-03 0.440E-06-0.558E-11
DMP: 145 0.108287971488E+05 -0.82126E-03 -0.13673E-03 30528 0.209E-03 0.347E-03
gam= 0.382 g(H,U,f)= 0.203E-03 0.255E-06-0.319E-11 ort(H,U,f) = 0.336E-03 0.425E-06-0.535E-11
DMP: 146 0.108287963416E+05 -0.80717E-03 -0.13286E-03 30528 0.203E-03 0.337E-03