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  1. ~~~~~~~Runnung on Opteron 6272, number of proceses =1~~~~~~~~~~
  2.  
  3. ================================================================
  4. BIG MEMORY ALLOCATIONS
  5. GDE 28107807 PME 112431230
  6. GDE 28107807 PME 112431230
  7. CATOM 34594200 PME 112431230
  8. GDE 28107807 PME 112431230
  9. SCR 22560446 GDE 28107807
  10. ----------------------------------------------------------------
  11. [PEAK NUMBER 123] PEAK MEMORY 275901467 = 2207.2 MBytes
  12. ================================================================
  13.  
  14.  
  15. ****************************************************************
  16. * *
  17. * TIMING *
  18. * *
  19. ****************************************************************
  20. SUBROUTINE CALLS CPU TIME ELAPSED TIME
  21. INVFFTN 26264 1349.77 1372.20
  22. FWFFTN 13230 893.04 907.39
  23. FFT-G/S 120896 670.99 683.60
  24. ODIIS 82 253.43 262.09
  25. VPSI 277 212.48 216.22
  26. RHOOFR 133 175.96 179.22
  27. ROTATE 234 159.77 161.41
  28. OVLAP 235 156.94 159.01
  29. EICALC 134 113.11 114.76
  30. RGS 82 107.12 110.25
  31. FWFFT 670 74.35 75.52
  32. RNLSM2 51 71.66 71.90
  33. RNLSM1 277 65.08 66.39
  34. FNONLOC 277 62.09 63.14
  35. VOFRHOA 134 53.49 53.55
  36. N-FFTCOM 39494 47.33 48.12
  37. GCENER 134 45.37 46.14
  38. INVFFT 537 45.07 45.77
  39. FORCES 133 18.85 19.18
  40. KIN_ENERGY 133 18.23 18.54
  41. XCENER 134 16.13 16.39
  42. GRADEN 134 16.09 16.37
  43. ----------------------------------------------------------------
  44. TOTAL TIME 4626.34 4707.19
  45. ****************************************************************
  46.  
  47. CPU TIME : 1 HOURS 17 MINUTES 54.73 SECONDS
  48. ELAPSED TIME : 1 HOURS 20 MINUTES 44.95 SECONDS
  49. *** CPMD| SIZE OF THE PROGRAM IS 318764/ 748892 kBYTES ***
  50.  
  51.  
  52.  
  53.  
  54.  
  55.  
  56.  
  57. ~~~~~~~~~~Runnung on Opteron 6272, number of proceses = 2~~~~~~~~
  58. ================================================================
  59. BIG MEMORY ALLOCATIONS
  60. PME 56216630 GDE 14054157
  61. GDE 14054157 PME 56216630
  62. PME 56216630 CATOM 17297400
  63. GDE 14054157 PME 56216630
  64. SCR 11317526 GDE 14054157
  65. ----------------------------------------------------------------
  66. [PEAK NUMBER 123] PEAK MEMORY 138629441 = 1109.0 MBytes
  67. ================================================================
  68.  
  69.  
  70. ****************************************************************
  71. * *
  72. * TIMING *
  73. * *
  74. ****************************************************************
  75. SUBROUTINE CALLS CPU TIME ELAPSED TIME
  76. INVFFTN 26264 684.73 687.92
  77. FWFFTN 13230 452.08 453.60
  78. FFT-G/S 120896 362.40 363.84
  79. ODIIS 82 132.33 132.85
  80. VPSI 277 107.54 107.58
  81. RHOOFR 133 95.01 95.46
  82. ROTATE 234 80.19 80.55
  83. OVLAP 235 78.72 79.30
  84. N-FFTCOM 39494 61.59 61.55
  85. EICALC 134 56.88 57.07
  86. RGS 82 52.63 53.29
  87. FWFFT 670 37.62 37.73
  88. RNLSM2 51 34.62 34.78
  89. RNLSM1 277 31.88 32.14
  90. FNONLOC 277 31.27 31.33
  91. VOFRHOA 134 26.38 26.49
  92. INVFFT 537 23.01 23.09
  93. GCENER 134 22.93 22.99
  94. FORCES 133 9.41 9.47
  95. KIN_ENERGY 133 9.05 9.11
  96. XCENER 134 8.17 8.20
  97. GRADEN 134 8.15 8.19
  98. FFTCOM 1207 7.79 7.85
  99. ----------------------------------------------------------------
  100. TOTAL TIME 2414.37 2424.40
  101. ****************************************************************
  102.  
  103. CPU TIME : 0 HOURS 40 MINUTES 38.38 SECONDS
  104. ELAPSED TIME : 0 HOURS 42 MINUTES 24.01 SECONDS
  105. *** CPMD| SIZE OF THE PROGRAM IS 182740/ 499968 kBYTES ***
  106.  
  107. ================================================================
  108. = COMMUNICATION TASK AVERAGE MESSAGE LENGTH NUMBER OF CALLS =
  109. = SEND/RECEIVE 289277. BYTES 1561. =
  110. = BROADCAST 29904. BYTES 707. =
  111. = GLOBAL SUMMATION 53090. BYTES 2585. =
  112. = GLOBAL MULTIPLICATION 0. BYTES 1. =
  113. = ALL TO ALL COMM 3201416. BYTES 40701. =
  114. = PERFORMANCE TOTAL TIME =
  115. = SEND/RECEIVE 1983.692 MB/S 0.228 SEC =
  116. = BROADCAST 2093.039 MB/S 0.010 SEC =
  117. = GLOBAL SUMMATION 146.175 MB/S 0.939 SEC =
  118. = GLOBAL MULTIPLICATION 0.000 MB/S 0.001 SEC =
  119. = ALL TO ALL COMM 1880.416 MB/S 69.294 SEC =
  120. = SYNCHRONISATION 0.078 SEC =
  121. ================================================================
  122.  
  123.  
  124.  
  125.  
  126.  
  127.  
  128.  
  129.  
  130. ~~~~~~~~~~Runnung on Opteron 6272, number of proceses =4~~~~~~~~
  131.  
  132. ================================================================
  133. BIG MEMORY ALLOCATIONS
  134. PME 28121030 PME 28121030
  135. PME 28121030 GDE 7030257
  136. GDE 7030257 CATOM 8652600
  137. GDE 7030257 PME 28121030
  138. SCR 5698406 GDE 7030257
  139. ----------------------------------------------------------------
  140. [PEAK NUMBER 123] PEAK MEMORY 69881455 = 559.1 MBytes
  141. ================================================================
  142.  
  143.  
  144. ****************************************************************
  145. * *
  146. * TIMING *
  147. * *
  148. ****************************************************************
  149. SUBROUTINE CALLS CPU TIME ELAPSED TIME
  150. INVFFTN 26264 404.33 406.27
  151. FWFFTN 13230 251.43 252.23
  152. FFT-G/S 120896 229.91 231.00
  153. ODIIS 82 71.67 71.95
  154. VPSI 277 69.59 69.67
  155. RHOOFR 133 68.97 69.30
  156. ROTATE 234 42.20 42.38
  157. OVLAP 235 41.11 41.32
  158. N-FFTCOM 39494 36.75 37.12
  159. EICALC 134 29.09 29.18
  160. RGS 82 27.61 27.84
  161. FWFFT 670 20.94 21.04
  162. FNONLOC 277 18.53 18.59
  163. RNLSM2 51 16.04 16.13
  164. RNLSM1 277 14.58 14.69
  165. VOFRHOA 134 13.79 13.82
  166. INVFFT 537 13.57 13.59
  167. GCENER 134 12.63 12.67
  168. FFTCOM 1207 5.86 5.89
  169. FORCES 133 5.30 5.32
  170. GRADEN 134 4.79 4.81
  171. KIN_ENERGY 133 4.57 4.59
  172. XCENER 134 4.47 4.47
  173. ----------------------------------------------------------------
  174. TOTAL TIME 1407.74 1413.83
  175. ****************************************************************
  176.  
  177. CPU TIME : 0 HOURS 23 MINUTES 43.71 SECONDS
  178. ELAPSED TIME : 0 HOURS 25 MINUTES 25.46 SECONDS
  179. *** CPMD| SIZE OF THE PROGRAM IS 120768/ 479736 kBYTES ***
  180.  
  181.  
  182. ================================================================
  183. = COMMUNICATION TASK AVERAGE MESSAGE LENGTH NUMBER OF CALLS =
  184. = SEND/RECEIVE 144619. BYTES 4683. =
  185. = BROADCAST 29820. BYTES 709. =
  186. = GLOBAL SUMMATION 53090. BYTES 2585. =
  187. = GLOBAL MULTIPLICATION 0. BYTES 1. =
  188. = ALL TO ALL COMM 1600799. BYTES 40701. =
  189. = PERFORMANCE TOTAL TIME =
  190. = SEND/RECEIVE 1851.517 MB/S 0.366 SEC =
  191. = BROADCAST 1170.584 MB/S 0.018 SEC =
  192. = GLOBAL SUMMATION 160.051 MB/S 1.715 SEC =
  193. = GLOBAL MULTIPLICATION 0.000 MB/S 0.001 SEC =
  194. = ALL TO ALL COMM 1518.505 MB/S 42.907 SEC =
  195. = SYNCHRONISATION 0.012 SEC =
  196. ================================================================
  197.  
  198.  
  199.  
  200.  
  201.  
  202.  
  203.  
  204.  
  205.  
  206. ~~~~~~~~Runnung on Opteron 6272, number of proceses =6~~~~~~~~~~
  207.  
  208. ================================================================
  209. BIG MEMORY ALLOCATIONS
  210. PME 18733730 PME 18733730
  211. GDE 4683432 SCR 3820946
  212. GDE 4683432 CATOM 5764200
  213. PME 18733730 PME 18733730
  214. GDE 4683432 GDE 4683432
  215. ----------------------------------------------------------------
  216. [PEAK NUMBER 123] PEAK MEMORY 46993905 = 376.0 MBytes
  217. ================================================================
  218.  
  219.  
  220. ****************************************************************
  221. * *
  222. * TIMING *
  223. * *
  224. ****************************************************************
  225. SUBROUTINE CALLS CPU TIME ELAPSED TIME
  226. INVFFTN 26264 289.79 290.82
  227. N-FFTCOM 39494 232.48 237.66
  228. FFT-G/S 120896 186.25 187.04
  229. FWFFTN 13230 171.74 172.21
  230. ODIIS 82 62.96 63.16
  231. VPSI 277 57.70 57.87
  232. RHOOFR 133 56.31 56.43
  233. ROTATE 234 29.50 29.63
  234. OVLAP 235 28.68 28.84
  235. EICALC 134 19.81 19.86
  236. RGS 82 18.78 18.91
  237. GLOSUM 1634 17.07 17.52
  238. FNONLOC 277 15.07 15.12
  239. FFTCOM 1207 14.88 15.11
  240. FWFFT 670 14.61 14.63
  241. RNLSM2 51 11.02 11.10
  242. RNLSM1 277 10.43 10.48
  243. INVFFT 537 9.61 9.61
  244. VOFRHOA 134 9.34 9.36
  245. GCENER 134 8.89 8.93
  246. FORCES 133 4.17 4.18
  247. GRADEN 134 3.57 3.58
  248. SUMFNL 277 3.50 3.60
  249. KIN_ENERGY 133 3.27 3.28
  250. XCENER 134 2.98 2.98
  251. ----------------------------------------------------------------
  252. TOTAL TIME 1282.40 1291.90
  253. ****************************************************************
  254.  
  255. CPU TIME : 0 HOURS 21 MINUTES 43.80 SECONDS
  256. ELAPSED TIME : 0 HOURS 23 MINUTES 24.20 SECONDS
  257. *** CPMD| SIZE OF THE PROGRAM IS 97936/ 388208 kBYTES ***
  258.  
  259.  
  260. ================================================================
  261. = COMMUNICATION TASK AVERAGE MESSAGE LENGTH NUMBER OF CALLS =
  262. = SEND/RECEIVE 96432. BYTES 7805. =
  263. = BROADCAST 29736. BYTES 711. =
  264. = GLOBAL SUMMATION 53090. BYTES 2585. =
  265. = GLOBAL MULTIPLICATION 0. BYTES 1. =
  266. = ALL TO ALL COMM 1103261. BYTES 40701. =
  267. = PERFORMANCE TOTAL TIME =
  268. = SEND/RECEIVE 1773.269 MB/S 0.424 SEC =
  269. = BROADCAST 788.499 MB/S 0.027 SEC =
  270. = GLOBAL SUMMATION 11.227 MB/S 31.598 SEC =
  271. = GLOBAL MULTIPLICATION 0.000 MB/S 0.001 SEC =
  272. = ALL TO ALL COMM 177.716 MB/S 252.672 SEC =
  273. = SYNCHRONISATION 0.146 SEC =
  274. ================================================================
  275.  
  276.  
  277.  
  278.  
  279.  
  280.  
  281.  
  282.  
  283.  
  284. ~~~~~~~~~~Runnung on Opteron 6272, number of proceses =8~~~~~~~~
  285.  
  286. ================================================================
  287. BIG MEMORY ALLOCATIONS
  288. CATOM 4330200 PME 14073230
  289. GDE 3518307 PME 14073230
  290. GDE 3518307 SCR 2888846
  291. PME 14073230 PME 14073230
  292. GDE 3518307 GDE 3518307
  293. ----------------------------------------------------------------
  294. [PEAK NUMBER 123] PEAK MEMORY 35506919 = 284.1 MBytes
  295. ================================================================
  296.  
  297.  
  298. ****************************************************************
  299. * *
  300. * TIMING *
  301. * *
  302. ****************************************************************
  303. SUBROUTINE CALLS CPU TIME ELAPSED TIME
  304. N-FFTCOM 39494 213.61 219.20
  305. INVFFTN 26264 199.93 201.19
  306. FWFFTN 13230 129.07 129.53
  307. FFT-G/S 120896 114.93 115.87
  308. ODIIS 82 46.79 47.11
  309. RHOOFR 133 35.57 35.72
  310. VPSI 277 35.57 35.91
  311. ROTATE 234 24.95 25.08
  312. OVLAP 235 21.56 21.67
  313. EICALC 134 15.41 15.48
  314. GLOSUM 1634 14.85 15.16
  315. RGS 82 14.29 14.46
  316. FFTCOM 1207 11.78 12.07
  317. FWFFT 670 10.63 10.67
  318. FNONLOC 277 10.19 10.24
  319. RNLSM2 51 8.52 8.57
  320. RNLSM1 277 7.76 7.83
  321. VOFRHOA 134 7.11 7.14
  322. GCENER 134 6.65 6.68
  323. INVFFT 537 6.55 6.58
  324. FORCES 133 2.63 2.64
  325. GRADEN 134 2.59 2.60
  326. KIN_ENERGY 133 2.56 2.57
  327. XCENER 134 2.31 2.32
  328. ----------------------------------------------------------------
  329. TOTAL TIME 945.80 956.31
  330. ****************************************************************
  331.  
  332. CPU TIME : 0 HOURS 16 MINUTES 6.92 SECONDS
  333. ELAPSED TIME : 0 HOURS 17 MINUTES 48.29 SECONDS
  334. *** CPMD| SIZE OF THE PROGRAM IS 124184/ 371968 kBYTES ***
  335.  
  336. ================================================================
  337. = COMMUNICATION TASK AVERAGE MESSAGE LENGTH NUMBER OF CALLS =
  338. = SEND/RECEIVE 72306. BYTES 10927. =
  339. = BROADCAST 29653. BYTES 713. =
  340. = GLOBAL SUMMATION 53090. BYTES 2585. =
  341. = GLOBAL MULTIPLICATION 0. BYTES 1. =
  342. = ALL TO ALL COMM 802387. BYTES 40701. =
  343. = PERFORMANCE TOTAL TIME =
  344. = SEND/RECEIVE 1918.959 MB/S 0.412 SEC =
  345. = BROADCAST 722.296 MB/S 0.029 SEC =
  346. = GLOBAL SUMMATION 14.883 MB/S 27.663 SEC =
  347. = GLOBAL MULTIPLICATION 0.000 MB/S 0.001 SEC =
  348. = ALL TO ALL COMM 141.266 MB/S 231.180 SEC =
  349. = SYNCHRONISATION 0.219 SEC =
  350. ================================================================
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