Execution Time2.49s

Test: UNRES_M_multi_checkgrad (Failed)
Build: devel Linux-ifort-MPI-DFA E0LL2Y (dell15) on 2020-04-05 04:03:50
Repository revision: f2129863e0bb6c820119c51c77185b744f615b84

Exit Value1

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Test output
CTEST_FULL_OUTPUT
Bye Bye...
Bye Bye...
 2  
    
 2  
    
 JESTEM
 JESTEM
 JESTEM
 JESTEM
 JESTEM
 JESTEM
 indpdb=          16  pdbref= T
 ns=           0
 Call Read_Bridge.
 ns=           0
Calling CHECK_ECARTINT   1.000D-04
           0
           1
           2
           3
           4
           5
           6
           7
           8
           9
          10
          11
          12
          13
          14
          15
          16
          17
          18
          19
          20
          21
          22
          23
          24
          25
          26
          27
          28
          29
          30
          31
          32
          33
          34
          35
          36
          37
          38
          39
          40
          41
          42
          43
          44
          45
          46
          47
          48
          49
          50
          51
          52
          53
          54
          55
          56
          57
          58
          59
          60
          61
          62
          63
          64
          65
          66
          67
          68
          69
          70
          71
          72
          73
          74
          75
          76
          77
          78
          79
          80
          81
          82
          83
          84
          85
 Processor           1  CG group           0  absolute rank           1 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
  5.583763122558594E-004  order[           1 ]  0.000000000000000E+000  order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]  0.000000000000000E+000  order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  2.234220504760742E-002  order[
           8 ]  0.000000000000000E+000  order[           9 ]
  0.000000000000000E+000  order[          10 ]  0.000000000000000E+000
 Total wall clock time   2.31849288940430       sec
 Processor           0  BROADCAST time  2.206802368164062E-003  REDUCE time
  2.006530761718750E-003  GATHER time  0.000000000000000E+000  SCATTER time
  0.000000000000000E+000  SENDRECV  0.000000000000000E+000  BARRIER ene
  1.328468322753906E-003  BARRIER grad  3.814697265625000E-006
CG processor   0 is finishing work.
Largest abs(1-numerical/analytical)=  15.8984
Sorted:
   1 -1.25196E+01
   2 -6.46666E-01
   3 -4.62891E-02
   4  5.77500E-02
   5  8.25492E-02
   6  4.78084E-01
   7  5.91856E-01
   8  6.32548E-01
   9  6.82130E-01
  10  6.86471E-01
  11  7.15656E-01
  12  7.26043E-01
  13  7.74278E-01
  14  8.23116E-01
  15  8.38758E-01
  16  8.44286E-01
  17  8.50170E-01
  18  8.56602E-01
  19  8.69648E-01
  20  8.78942E-01
  21  8.84208E-01
  22  8.90455E-01
  23  8.99022E-01
  24  9.17964E-01
  25  9.26048E-01
  26  9.26817E-01
  27  9.29055E-01
  28  9.31846E-01
  29  9.35098E-01
  30  9.41238E-01
  31  9.46452E-01
  32  9.48067E-01
  33  9.49417E-01
  34  9.49775E-01
  35  9.51694E-01
  36  9.51741E-01
  37  9.52784E-01
  38  9.55824E-01
  39  9.57109E-01
  40  9.58192E-01
  41  9.59456E-01
  42  9.63614E-01
  43  9.65323E-01
  44  9.67395E-01
  45  9.68141E-01
  46  9.72982E-01
  47  9.74805E-01
  48  9.75403E-01
  49  9.76529E-01
  50  9.76878E-01
  51  9.80382E-01
  52  9.81687E-01
  53  9.82936E-01
  54  9.83413E-01
  55  9.83433E-01
  56  9.84227E-01
  57  9.84808E-01
  58  9.86023E-01
  59  9.86317E-01
  60  9.86889E-01
  61  9.87473E-01
  62  9.88482E-01
  63  9.88492E-01
  64  9.89513E-01
  65  9.90318E-01
  66  9.90530E-01
  67  9.91849E-01
  68  9.93872E-01
  69  9.94383E-01
  70  9.94390E-01
  71  9.94989E-01
  72  9.95212E-01
  73  9.95466E-01
  74  9.95719E-01
  75  9.95981E-01
  76  9.96230E-01
  77  9.96242E-01
  78  9.96254E-01
  79  9.96579E-01
  80  9.96666E-01
  81  9.97772E-01
  82  9.97788E-01
  83  9.97864E-01
  84  9.97872E-01
  85  9.97993E-01
  86  9.98238E-01
  87  9.98315E-01
  88  9.98334E-01
  89  9.98395E-01
  90  9.98443E-01
  91  9.98540E-01
  92  9.98545E-01
  93  9.98547E-01
  94  9.98554E-01
  95  9.98606E-01
  96  9.98661E-01
  97  9.98836E-01
  98  9.98846E-01
  99  9.98912E-01
 100  9.98959E-01
 101  9.99020E-01
 102  9.99024E-01
 103  9.99059E-01
 104  9.99084E-01
 105  9.99104E-01
 106  9.99115E-01
 107  9.99132E-01
 108  9.99147E-01
 109  9.99155E-01
 110  9.99199E-01
 111  9.99219E-01
 112  9.99242E-01
 113  9.99276E-01
 114  9.99318E-01
 115  9.99433E-01
 116  9.99514E-01
 117  9.99584E-01
 118  9.99609E-01
 119  9.99702E-01
 120  9.99714E-01
 121  9.99744E-01
 122  9.99867E-01
 123  9.99868E-01
 124  9.99872E-01
 125  9.99902E-01
 126  9.99937E-01
 127  9.99937E-01
 128  9.99971E-01
 129  9.99978E-01
 130  9.99984E-01
 131  9.99987E-01
 132  9.99995E-01
 133  9.99995E-01
 134  9.99998E-01
 135  9.99999E-01
 136  9.99999E-01
 137  9.99999E-01
 138  1.00000E+00
 139  1.00000E+00
 140  1.00000E+00
 141  1.00000E+00
 142  1.00000E+00
 143  1.00000E+00
 144  1.00000E+00
 145  1.00000E+00
 146  1.00000E+00
 147  1.00000E+00
 148  1.00000E+00
 149  1.00000E+00
 150  1.00000E+00
 151  1.00000E+00
 152  1.00000E+00
 153  1.00000E+00
 154  1.00000E+00
 155  1.00000E+00
 156  1.00000E+00
 157  1.00000E+00
 158  1.00000E+00
 159  1.00000E+00
 160  1.00000E+00
 161  1.00000E+00
 162  1.00000E+00
 163  1.00000E+00
 164  1.00000E+00
 165  1.00000E+00
 166  1.00000E+00
 167  1.00000E+00
 168  1.00000E+00
 169  1.00000E+00
 170  1.00000E+00
 171  1.00000E+00
 172  1.00000E+00
 173  1.00000E+00
 174  1.00000E+00
 175  1.00000E+00
 176  1.00000E+00
 177  1.00000E+00
 178  1.00000E+00
 179  1.00000E+00
 180  1.00000E+00
 181  1.00000E+00
 182  1.00000E+00
 183  1.00000E+00
 184  1.00000E+00
 185  1.00000E+00
 186  1.00000E+00
 187  1.00000E+00
 188  1.00000E+00
 189  1.00000E+00
 190  1.00000E+00
 191  1.00000E+00
 192  1.00000E+00
 193  1.00000E+00
 194  1.00000E+00
 195  1.00000E+00
 196  1.00000E+00
 197  1.00000E+00
 198  1.00000E+00
 199  1.00000E+00
 200  1.00000E+00
 201  1.00000E+00
 202  1.00000E+00
 203  1.00000E+00
 204  1.00000E+00
 205  1.00000E+00
 206  1.00000E+00
 207  1.00000E+00
 208  1.00000E+00
 209  1.00000E+00
 210  1.00000E+00
 211  1.00000E+00
 212  1.00000E+00
 213  1.00000E+00
 214  1.00000E+00
 215  1.00000E+00
 216  1.00000E+00
 217  1.00000E+00
 218  1.00000E+00
 219  1.00000E+00
 220  1.00000E+00
 221  1.00000E+00
 222  1.00000E+00
 223  1.00000E+00
 224  1.00000E+00
 225  1.00000E+00
 226  1.00000E+00
 227  1.00000E+00
 228  1.00000E+00
 229  1.00000E+00
 230  1.00000E+00
 231  1.00000E+00
 232  1.00000E+00
 233  1.00000E+00
 234  1.00000E+00
 235  1.00000E+00
 236  1.00000E+00
 237  1.00000E+00
 238  1.00000E+00
 239  1.00000E+00
 240  1.00000E+00
 241  1.00000E+00
 242  1.00000E+00
 243  1.00000E+00
 244  1.00000E+00
 245  1.00000E+00
 246  1.00000E+00
 247  1.00000E+00
 248  1.00000E+00
 249  1.00000E+00
 250  1.00000E+00
 251  1.00000E+00
 252  1.00000E+00
 253  1.00000E+00
 254  1.00000E+00
 255  1.00000E+00
 256  1.00000E+00
 257  1.00000E+00
 258  1.00000E+00
 259  1.00000E+00
 260  1.00000E+00
 261  1.00000E+00
 262  1.00000E+00
 263  1.00000E+00
 264  1.00000E+00
 265  1.00000E+00
 266  1.00000E+00
 267  1.00000E+00
 268  1.00000E+00
 269  1.00000E+00
 270  1.00000E+00
 271  1.00000E+00
 272  1.00000E+00
 273  1.00000E+00
 274  1.00000E+00
 275  1.00000E+00
 276  1.00000E+00
 277  1.00000E+00
 278  1.00000E+00
 279  1.00000E+00
 280  1.00000E+00
 281  1.00000E+00
 282  1.00000E+00
 283  1.00000E+00
 284  1.00000E+00
 285  1.00000E+00
 286  1.00000E+00
 287  1.00000E+00
 288  1.00000E+00
 289  1.00000E+00
 290  1.00000E+00
 291  1.00000E+00
 292  1.00000E+00
 293  1.00000E+00
 294  1.00000E+00
 295  1.00000E+00
 296  1.00000E+00
 297  1.00000E+00
 298  1.00000E+00
 299  1.00000E+00
 300  1.00000E+00
 301  1.00000E+00
 302  1.00000E+00
 303  1.00000E+00
 304  1.00000E+00
 305  1.00000E+00
 306  1.00000E+00
 307  1.00000E+00
 308  1.00000E+00
 309  1.00000E+00
 310  1.00000E+00
 311  1.00000E+00
 312  1.00000E+00
 313  1.00000E+00
 314  1.00000E+00
 315  1.00000E+00
 316  1.00000E+00
 317  1.00000E+00
 318  1.00000E+00
 319  1.00000E+00
 320  1.00000E+00
 321  1.00000E+00
 322  1.00000E+00
 323  1.00000E+00
 324  1.00000E+00
 325  1.00000E+00
 326  1.00000E+00
 327  1.00000E+00
 328  1.00000E+00
 329  1.00000E+00
 330  1.00000E+00
 331  1.00000E+00
 332  1.00000E+00
 333  1.00000E+00
 334  1.00000E+00
 335  1.00000E+00
 336  1.00000E+00
 337  1.00000E+00
 338  1.00000E+00
 339  1.00000E+00
 340  1.00000E+00
 341  1.00000E+00
 342  1.00000E+00
 343  1.00000E+00
 344  1.00000E+00
 345  1.00000E+00
 346  1.00000E+00
 347  1.00000E+00
 348  1.00000E+00
 349  1.00000E+00
 350  1.00000E+00
 351  1.00000E+00
 352  1.00000E+00
 353  1.00000E+00
 354  1.00000E+00
 355  1.00000E+00
 356  1.00000E+00
 357  1.00000E+00
 358  1.00000E+00
 359  1.00000E+00
 360  1.00000E+00
 361  1.00000E+00
 362  1.00000E+00
 363  1.00000E+00
 364  1.00000E+00
 365  1.00000E+00
 366  1.00000E+00
 367  1.00000E+00
 368  1.00000E+00
 369  1.00000E+00
 370  1.00000E+00
 371  1.00000E+00
 372  1.00000E+00
 373  1.00000E+00
 374  1.00000E+00
 375  1.00000E+00
 376  1.00000E+00
 377  1.00000E+00
 378  1.00000E+00
 379  1.00000E+00
 380  1.00000E+00
 381  1.00000E+00
 382  1.00000E+00
 383  1.00000E+00
 384  1.00000E+00
 385  1.00000E+00
 386  1.00000E+00
 387  1.00000E+00
 388  1.00000E+00
 389  1.00000E+00
 390  1.00000E+00
 391  1.00000E+00
 392  1.00001E+00
 393  1.00001E+00
 394  1.00003E+00
 395  1.00003E+00
 396  1.00005E+00
 397  1.00006E+00
 398  1.00007E+00
 399  1.00015E+00
 400  1.00015E+00
 401  1.00016E+00
 402  1.00018E+00
 403  1.00027E+00
 404  1.00027E+00
 405  1.00031E+00
 406  1.00032E+00
 407  1.00033E+00
 408  1.00035E+00
 409  1.00037E+00
 410  1.00039E+00
 411  1.00040E+00
 412  1.00040E+00
 413  1.00043E+00
 414  1.00050E+00
 415  1.00051E+00
 416  1.00053E+00
 417  1.00053E+00
 418  1.00058E+00
 419  1.00061E+00
 420  1.00068E+00
 421  1.00079E+00
 422  1.00087E+00
 423  1.00105E+00
 424  1.00106E+00
 425  1.00111E+00
 426  1.00111E+00
 427  1.00126E+00
 428  1.00129E+00
 429  1.00131E+00
 430  1.00151E+00
 431  1.00168E+00
 432  1.00185E+00
 433  1.00188E+00
 434  1.00214E+00
 435  1.00220E+00
 436  1.00227E+00
 437  1.00258E+00
 438  1.00286E+00
 439  1.00306E+00
 440  1.00347E+00
 441  1.00367E+00
 442  1.00379E+00
 443  1.00411E+00
 444  1.00421E+00
 445  1.00427E+00
 446  1.00429E+00
 447  1.00469E+00
 448  1.00509E+00
 449  1.00520E+00
 450  1.00522E+00
 451  1.00870E+00
 452  1.00954E+00
 453  1.01009E+00
 454  1.01060E+00
 455  1.01259E+00
 456  1.01299E+00
 457  1.01306E+00
 458  1.01350E+00
 459  1.01364E+00
 460  1.01480E+00
 461  1.01568E+00
 462  1.01927E+00
 463  1.02169E+00
 464  1.02523E+00
 465  1.02564E+00
 466  1.02567E+00
 467  1.03760E+00
 468  1.04084E+00
 469  1.04247E+00
 470  1.04967E+00
 471  1.05220E+00
 472  1.06031E+00
 473  1.07149E+00
 474  1.07269E+00
 475  1.08145E+00
 476  1.08911E+00
 477  1.09843E+00
 478  1.11691E+00
 479  1.12236E+00
 480  1.13604E+00
 481  1.14207E+00
 482  1.15107E+00
 483  1.16125E+00
 484  1.17053E+00
 485  1.18865E+00
 486  1.19463E+00
 487  1.19701E+00
 488  1.20687E+00
 489  1.21272E+00
 490  1.21410E+00
 491  1.27273E+00
 492  1.27891E+00
 493  1.30280E+00
 494  1.31405E+00
 495  1.33851E+00
 496  1.70258E+00
 497  1.72703E+00
 498  2.12883E+00
 499  2.13839E+00
 500  3.50363E+00
 501  1.68984E+01
ERROR largest abs(1-numerical/analytical) 15.8984000000
 greater than 0.025