| ²é¿´: 2103 | »Ø¸´: 6 | ||||
[½»Á÷]
¡¾ÇóÖú¡¿CASTEP MPI ÔËÐдíÎó
|
|
ÇëÎÊ´ó¼ÒÖªµÀÊÇʲôÎÊÌâÂ𣿠castepÔËÐÐserial jobÊÇûÎÊÌâµÄ£¬µ«ÔËÐÐmpi¾Í²úÉú´íÎó: /home/kk/local/Accelrys/MS55/bin/castepexe_mpi.exe: error while loading shared libraries : libls_license64_g346.so: cannot open shared object file: No such file or directory MPI Application rank 0 exited before MPI_Init() with status 127 "libls_license64_g346.so" Ã÷Ã÷¾ÍÔÚ ~/local/Accelrys/LicensePack/linux/lib ÔÚ~/share/bin/runMSserver.sh ¼ÓÒ»ÐÐ, echo $LD_LIBRARY_PATH (ÈçÏÂ), ¿É¼ûÕâÎļþ¼ÐÒ²ÔÚ$LD_LIBRARY_PATHÉÏŶ£¬¸ÉÂðÕÒ²»µ½Å¶? #xx echo $LD_LIBRARY_PATH /home/kk/local/Accelrys/MS55/lib/5.8.9/x86_64-linux-thread-multi/CORE:/home/kk/local/Accelrys/LicensePack/linux/lib:/home/kk/local/Accelrys/MS55//lib:/home/kk/local/Accelrys/MS55//lib/32:/opt/intel/Compiler/11.1/059/lib/intel64:/opt/intel/Compiler/11.1/059/ipp/em64t/sharedlib:/opt/intel/Compiler/11.1/059/mkl/lib/em64t:/opt/intel/Compiler/11.1/059/tbb/intel64/cc4.1.0_libc2.4_kernel2.6.16.21/lib:/opt/intel/Compiler/11.1/059/lib/intel64:/opt/intel/Compiler/11.1/059/ipp/em64t/sharedlib:/opt/intel/Compiler/11.1/059/mkl/lib/em64t:/opt/intel/Compiler/11.1/059/tbb/intel64/cc4.1.0_libc2.4_kernel2.6.16.21/lib #x $MS_INSTALL_ROOT/bin/perl $DSD_ROOT/servers/$ser £¨°´£¬Õâ´íÎó²»µ¥ÊÇcastep£¬ÆäËüÄ£¿éÒ²²»ÄÜÔËÐÐmpi£© |
» ÊÕ¼±¾ÌûµÄÌÔÌûר¼ÍƼö
MaterialsStudio |
» ²ÂÄãϲ»¶
085600£¬²ÄÁÏÓ뻯¹¤321·ÖÇóµ÷¼Á
ÒѾÓÐ5È˻ظ´
Çó»¯Ñ§µ÷¼Á
ÒѾÓÐ3È˻ظ´
µ÷¼ÁÇóԺУÕÐÊÕ
ÒѾÓÐ3È˻ظ´
²ÄÁÏÓ뻯¹¤£¨0856£©304ÇóBÇøµ÷¼Á
ÒѾÓÐ8È˻ظ´
320·Ö£¬²ÄÁÏÓ뻯¹¤×¨Òµ£¬Çóµ÷¼Á
ÒѾÓÐ11È˻ظ´
0856Çóµ÷¼Á
ÒѾÓÐ10È˻ظ´
266·Ö£¬Çó²ÄÁÏÒ±½ðÄÜÔ´»¯¹¤µÈµ÷¼Á
ÒѾÓÐ9È˻ظ´
085600 286·Ö ²ÄÁÏÇóµ÷¼Á
ÒѾÓÐ8È˻ظ´
085701»·¾³¹¤³Ì£¬267Çóµ÷¼Á
ÒѾÓÐ16È˻ظ´
286Çóµ÷¼Á
ÒѾÓÐ12È˻ظ´
» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:
castep¼ÆËãFe2O3Éù×ÓÆ×ʧ°Ü£¬ÔÒòÇó½Ì~~
ÒѾÓÐ10È˻ظ´
CASTEP¼ÆËã³ö´í£¬ºÃÏñÊDz¢ÐгöÁËÎÊÌ⣬Çë´ó¼Ò°ïÎÒ¿´Ò»ÏÂ
ÒѾÓÐ7È˻ظ´
ÇëÎÊMS-linux-cluster°²×°Ö®ºóÎÞ·¨²¢ÐеÄÎÊÌ⣿
ÒѾÓÐ5È˻ظ´
¡¾ÇóÖú¡¿MSÔËÐб¨´í The job has failed. Download any results generated so far?
ÒѾÓÐ20È˻ظ´
¡¾ÇóÖú¡¿CASTEPÀïµÄ²ÎÊýÔõôÉ裿
ÒѾÓÐ8È˻ظ´
¡¾ÇóÖú¡¿Çë´ó¼Ò°ïæ½â¾öMSÔËÐÐÎÊÌâ
ÒѾÓÐ9È˻ظ´
¡¾ÇóÖú¡¿castep
ÒѾÓÐ17È˻ظ´
¡¾ÇóÖú¡¿³ÌÐòʧ°ÜMPI_Allreduce: malloc failed: See malloc(3C) for details
ÒѾÓÐ9È˻ظ´
¡¾ÇóÖú¡¿castep ÄÜÁ¿¼ÆËãʧ°Ü£¡
ÒѾÓÐ12È˻ظ´
» ÇÀ½ð±ÒÀ²£¡»ØÌû¾Í¿ÉÒԵõ½:
Àϳæ×ÓµÄ×¢²áСľ³æ18ÖÜÄê´óÀñ°ü
+5/150
̫ԿƼ¼´óѧ²ÄÁÏ¿ÆÑ§Ó빤³ÌѧԺÕÐÊÕ½ðÊô²ÄÁÏÀ಩ʿһÃû
+1/82
Çൺ¿Æ¼¼´óѧÉúÎ﹤³ÌѧԺÕе÷¼Á˶ʿÑо¿Éú
+1/71
Áôѧ--²©Ê¿ÕÐÉú
+1/50
¹ã¶«Î¨Ò»Ê¯»¯ÔºÐ£¡ª¡ª×ÊÔ´Óë»·¾³×¨Ë¶ÕÐÉú
+1/42
Çò²îÏà¹ØÖªÊ¶
+1/38
ÕÐÊÕ2ÃûÍÁľ¹¤³Ì·½Ïò˶ʿÑо¿Éú
+1/37
¹ú¼Ò˫һÁ÷¸ßУ-¹ú¼Ò¼¶ÇàÄêÈ˲ſÎÌâ×鲩ʿÕÐÉú
+2/32
ÉϺ£ÖÐÒ½Ò©´óѧ´´ÐÂÖÐÒ©Ñо¿Ôº ÕÐÊÕÉóºËÖÆ²©Ê¿ÉúÒ»Ãû
+1/17
˫һÁ÷´óÑ§ÏæÌ¶´óѧ¡°»¯¹¤¹ý³ÌÄ£ÄâÓëÇ¿»¯¡±¹ú¼ÒµØ·½ÁªºÏ¹¤³ÌÑо¿ÖÐÐÄÕÐÊÕ²©Ê¿Éú
+1/14
³¤½´óѧʯÓ͹¤³ÌѧԺ2026Äê˶ʿµ÷¼ÁÕÐÉú¹«¸æ!!!
+1/13
±±¾©Ê¯ÓÍ»¯¹¤Ñ§ÔºVOCs¾»»¯¼¼Êõ¿ÎÌâ×é ÕÐÊÕ2026¼¶Ë¶Ê¿µ÷¼Á
+1/9
¡¾²©Ê¿ÕÐÉú¡¿Ìì½òÀí¹¤´óѧ¹ú¼Ò½ÜÇàÍõÌú¿ÎÌâ×éÕÐÊÕ2026Ä격ʿÑо¿Éú
+1/8
ÄþÏÄ´óѧ»¯Ñ§»¯¹¤Ñ§ÔºÎºÒݱòÑо¿Ô±¿ÎÌâ×éÕÐÆ¸ÆôÊÂ
+1/7
ÄϾ©ÁÖÒµ´óѧ»¯Ñ§¹¤³ÌѧԺ°ØÐÊ·å¿ÎÌâ×éÕÐÊÕ˶ʿÑо¿Éú1Ãû
+1/6
ÄÏ¿ª´óѧ»·¾³¿ÆÑ§Ó빤³ÌѧԺÍõöνÌÊÚ¿ÎÌâ×éÕÐÊÕÉêÇ뿼ºËÖÆ²©Ê¿Éú
+1/6
°ÄÃÅÀí¹¤´óѧ2026È˹¤ÖÇÄÜÒ©Îï·¢ÏÖ²©Ê¿£¨½±Ñ§½ð+ÉêÇ뿼ºË£©
+1/5
¡¾²©Ê¿ÕÐÉú¡¿¹ã¶«¹¤Òµ´óѧ¹ú¼ÒÓÅÇà¿ÎÌâ×éÕÐÊÕ2026Äê»·¾³·½Ïò²©Ê¿Éú
+1/5
Çóµ÷¼Á
+1/2
ÌÕ´ÉĤ¿×¾¶²âÊÔ·½·¨½âÎö¡ª¡ª¡ªÓÅÑ¡·½°¸Óë¼¼Êõ·¢Õ¹
+1/1
lbambool
ľ³æ (ÖøÃûдÊÖ)
- 1STÇ¿Ìû: 7
- Ó¦Öú: 35 (СѧÉú)
- ½ð±Ò: 3755.1
- Ìû×Ó: 2403
- ÔÚÏß: 393.4Сʱ
- ³æºÅ: 96218
¡ï ¡ï
saikun(½ð±Ò+3):лл²ÎÓë
zzy870720z(½ð±Ò+1): лл½»Á÷ 2011-01-21 19:28:28
saikun(½ð±Ò+3):лл²ÎÓë
zzy870720z(½ð±Ò+1): лл½»Á÷ 2011-01-21 19:28:28
| °Ñms_setup.sh -s bash¸ÄΪ shÊÔÊÔ |
2Â¥2011-01-21 19:14:00
¡ï
saikun(½ð±Ò+3):лл²ÎÓë
saikun(½ð±Ò+3):лл²ÎÓë
| ÎÒ°²×°µÄÊÇdmolÄ£¿é£¬µ¥»ú¶àºË¿ÉÒÔ²¢ÐУ¬µ«ÊǶà»ú²¢ÐУ¬¾Í³öÏÖºÍÄãÒ»ÑùµÄ´íÎó£¬ÄãÕâ¸öÎÊÌâ½â¾öÁËÂð£¿Ôõô½â¾öµÄѽ£¿ |
3Â¥2011-06-13 22:27:38
ºØÒÇ
Ìú¸Ëľ³æ (ÖøÃûдÊÖ)
- 1STÇ¿Ìû: 5
- Ó¦Öú: 93 (³õÖÐÉú)
- ¹ó±ö: 0.636
- ½ð±Ò: 5937
- Ìû×Ó: 2499
- ÔÚÏß: 588.7Сʱ
- ³æºÅ: 995125
¡ï
saikun(½ð±Ò+3):лл²ÎÓë
saikun(½ð±Ò+3):лл²ÎÓë
|
ÎÒÏëÎÊһϠÄã°²×°ÁËmpiûÓУ¿ ÄãµÄLD_LIBRARY_PATHÀïÃæÃ»ÓÐmpiµÄ¿â |
4Â¥2011-06-14 12:36:31
5Â¥2012-05-23 17:47:29
¡ï
saikun(½ð±Ò+3): лл²ÎÓë
saikun(½ð±Ò+3): лл²ÎÓë
|
ϵͳÕÒ²»µ½Õâ¸ö¿âÎļþ£¬ÐèÒªÔÚ»·¾³±äÁ¿ÀïÉùÃ÷һϰ¡¡£ /Accelrys/LicensePack/linux/bin ²»ºÃÒâ˼£¬ÎÒд´í·¾¶ÁË£¬ ÔÚÄãµÄbashrcÀïÃæ¼ÓÈëÒ»ÐУ¬¾Í¿ÉÒÔÁË¡£ export LD_LIBRARY_PATH=/export/home/binli/Accelrys/LicensePack/linux/lib:$LD_LIBRARY_PATH ¾ÍÊǸæËßϵͳÕâ¸öÎļþËùÔڵķ¾¶£¬ÎÒ°²×°µÄÊÇMS 6.0 £¬ÆäĿ¼Ϊ /export/home/binli/Accelrys/LicensePack/linux/lib Ŀ¼ÏÂÃæÓÐÈçÏÂÎļþ£º -rwxrwxr-x. 1 binli binli 2227376 Sep 27 2011 libls_license64_g346.so -rwxrwxr-x. 1 binli binli 2145043 Sep 27 2011 libls_license64_g411.so -rwxrwxr-x. 1 binli binli 2412981 Sep 27 2011 libls_license_g323.so -rwxrwxr-x. 1 binli binli 2409844 Sep 27 2011 libls_license_g323s.so -rwxrwxr-x. 1 binli binli 2380611 Sep 27 2011 libls_license_g346.so -rwxrwxr-x. 1 binli binli 5056567 Sep 27 2011 libls_licenseRH7_01i7.so -rwxrwxr-x. 1 binli binli 2123776 Sep 27 2011 libls_licenseRH7_g01.so -rwxrwxr-x. 1 binli binli 2098394 Sep 27 2011 libls_licenseRH7_g01s.so ËûÃdzöÏÖÁËÕâ¸öÎÊÌ⣬ÎÒÓÃÕâ¸ö·½·¨½«ÎÊÌâ½â¾öÁË¡£ ×£ºÃ¡£ [ Last edited by vasp001 on 2013-2-3 at 23:25 ] |
6Â¥2012-05-23 17:48:41
7Â¥2013-02-03 23:10:35














»Ø¸´´ËÂ¥