Znn3bq.jpeg
²é¿´: 486  |  »Ø¸´: 9
µ±Ç°Ö÷ÌâÒѾ­´æµµ¡£
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

cenwanglai

ÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)

ÀϺÍɽâ«ËöÅɾŶÎ

ÓÅÐã°æÖ÷

[½»Á÷] ¡¾ÇóÖú¡¿EM64T+32bit linux,vasp¿É²»¿ÉÒÔ±àÒë³É32λµÄ?

ÄãºÃ:
CPU: Xeon5410 EM64T ËĺË;
OS: rhel 5.2(32bit)

(1)±àÒëVaspѡʲômakefile.machine? ¸ø³öµÄmakefile.machineÑ¡ÏîÖÐûÓÐmakefile_linux_ifc_em64tÄØ.ÎÒÑ¡makefile.linux_ifc_P4Ã²ËÆÔÚvasp.x.libÖпÉÒÔmake.

(2)ÔÚvasp.x.xµÄmakefileÖÐÐÞ¸ÄÊýѧ¿âµÄʱºò,¿É²»¿ÉÒÔÑ¡xxx/32, ¶ø²»Ñ¡xxx/em64t? ÓÉÓÚÎÒµÄOS ÊÇ32λµÄ, °²×°HPMPIµÄʱºò(°²×°material studioʱ°²×°µÄ),Ö»Äܰ²×°i386(32bit)µÄ.

ÁíÍâ,ifortºÍmklÊǰ²×°ÔÚ/opt/intelĿ¼ÏµÄ,hpmpiÊǰ²×°ÔÚ/opt/hpmiĿ¼ÏµÄ.vaspÎļþ·ÅÔÚÒ»°ãÓû§Ä¿Â¼ÏÂ.ÒѾ­ÔÚ/rootÏÂÐÞ¸ÄÁËbashrcÀ´ÉèÖÃifort,mklºÍmpiµÄPATH,µ«ÊÇÎÒÔÚvasp.x.xÏÂmakeµÄʱºò,Ìáʾmpif90ÕÒ²»µ½.Ææ¹Ö.

ÖØÐÂÐÞ¸ÄÁË.bashrc,ûÓÐÌáʾÕÒ²»µ½Îļþ.

Ó¦¸Ã¿ÉÒÔ±àÒë32λ²¢ÐеÄÁË,ûÓÐerroÌáʾ.

[ Last edited by cenwanglai on 2009-11-17 at 17:22 ]
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

abcasi

½ð³æ (СÓÐÃûÆø)

Ðã²Å

ifort°²×°ºó£¬cp ifort /bin Ŀ¼Ï£¬ÔÙ×°mpich2

¡ï ¡ï
yjmaxpayne(½ð±Ò+2,VIP+0):лл 11-25 21:39
ifort°²×°ºó£¬cp ifort  /bin Ŀ¼Ï£¬ÔÙ×°mpich2
¾Í²»»á³öÏÖÏÂÃæµÄÎÊÌâ
mpif90ÕÒ²»µ½
óÆÑ§Ã÷µÂ
5Â¥2009-11-25 21:18:48
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 10 ¸ö»Ø´ð

cenwanglai

ÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)

ÀϺÍɽâ«ËöÅɾŶÎ

ÓÅÐã°æÖ÷

¡ï
fegg7502(½ð±Ò+1,VIP+0):thank you very much! 11-14 17:46
ÖØÐÂÉèÖÃÁËÒ»ÏÂ.bashrc,¿ÉÒÔmake.
µ«ÊÇ×îºómake: ***[vasp] ´íÎó 1.

ºÇºÇ,¼ÌÐø.
2Â¥2009-11-13 21:54:16
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

cenwanglai

ÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)

ÀϺÍɽâ«ËöÅɾŶÎ

ÓÅÐã°æÖ÷

¿ÉÒÔ±àÒë32λ²¢ÐеÄ,ûÓÐerroÌáʾ.µ«ÊǸµÁ¢Ò¶±ä»»·½Ã滹ÓеãÎÊÌá.¼ÌÐø.
½ð±Ò¿ÉÒÔ»¹¸øÎÒÂð?
ºÇºÇ

[ Last edited by cenwanglai on 2009-11-17 at 17:21 ]
3Â¥2009-11-17 17:19:21
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

abcasi

½ð³æ (СÓÐÃûÆø)

Ðã²Å

Äܳɹ¦

¡ï ¡ï ¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
yjmaxpayne(½ð±Ò+1,VIP+0):лл 11-25 21:38
yjmaxpayne(½ð±Ò+2,VIP+0):лл 11-25 21:39
ÎÒ±àÒë¹ýµÄ£¬¹Ø¼ü¾ÍÊÇBLAS=-L/opt/intel/mkl/9.1.023/lib/32 -lmkl_p4 -lsvml -lvml -lguide -lpthread
ÀïÃæµÄ²ÎÊýÉèÖÃ
óÆÑ§Ã÷µÂ
4Â¥2009-11-25 21:15:15
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 0854µ÷¼Á +6 ³¤¹­°Á 2026-04-09 6/300 2026-04-09 11:16 by 2451080013
[¿¼ÑÐ] 266µ÷¼Á +8 daya sun 2026-04-07 9/450 2026-04-08 20:27 by yutian743
[¿¼ÑÐ] Çóµ÷¼Á +9 ÔÂ@163.com 2026-04-07 11/550 2026-04-08 14:48 by qlm5820
[¿¼ÑÐ] 281Çóµ÷¼Á +10 Ò¬×ÓÄ¢¹½ 2026-04-06 10/500 2026-04-08 11:43 by zzucheup
[¿¼ÑÐ] ²ÄÁÏר˶ µ÷¼Á +17 CXN123456 2026-04-03 17/850 2026-04-08 11:10 by lijunpoly
[¿¼ÑÐ] »úеµ÷¼Á +3 zzzbcb 2026-04-07 3/150 2026-04-07 22:19 by hemengdong
[¿¼ÑÐ] Ò»Ö¾Ô¸ÄϿƴóÉúÎïѧ297·Ö£¬Çóµ÷¼ÁÍÆ¼ö +8 Y-yyusx 2026-04-06 9/450 2026-04-07 19:38 by biomichael
[¿¼ÑÐ] 085602µ÷¼Á ³õÊÔ×Ü·Ö335 +3 19123253302 2026-04-06 3/150 2026-04-07 18:00 by jp9609
[¿¼ÑÐ] 325 µ÷¼Á +6 QQСϺ 2026-04-07 6/300 2026-04-07 15:17 by Ccclqqq
[¿¼ÑÐ] ¹¤¿Æ 22408 267ÇóÍÆ¼ö +4 wanwan00 2026-04-05 5/250 2026-04-06 22:47 by chenzhimin
[¿¼ÑÐ] ²ÄÁÏר˶283Çóµ÷¼Á +17 ÊÔÊÔ¿´ß 2026-04-04 18/900 2026-04-06 09:24 by 286640313
[¿¼ÑÐ] 301Çóµ÷¼Á +3 XYPLR 2026-04-05 4/200 2026-04-05 19:07 by XYPLR
[¿¼ÑÐ] 284Çóµ÷¼Á +7 Ðìͬѧ_001 2026-04-04 13/650 2026-04-05 17:19 by yulian1987
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +12 Ò»ÑùYWY 2026-04-04 12/600 2026-04-05 08:24 by 544594351
[¿¼ÑÐ] Çóµ÷¼Á +4 êɹ¦? 2026-04-03 4/200 2026-04-04 21:58 by hemengdong
[¿¼ÑÐ] µ÷¼Á +9 19945159693 2026-04-03 10/500 2026-04-04 20:16 by dongzh2009
[¿¼ÑÐ] 319Çóµ÷¼Á +4 ÐÇÐDz»Õ£ÑÛà¶ 2026-04-03 4/200 2026-04-04 16:25 by ÖзÉÔº¿Õ¹ÜѧԺÑ
[¿¼ÑÐ] 22408Çóµ÷¼Á 354·Ö ¿É¿çרҵ +3 hannnnnnn 2026-04-04 3/150 2026-04-04 14:35 by ÍÁľ˶ʿÕÐÉú
[¿¼ÑÐ] ²ÄÁÏ295 +13 СӢ11 2026-04-03 14/700 2026-04-04 09:02 by À´¿´Á÷ÐÇÓê10
[¿¼ÑÐ] 281Çóµ÷¼Á +10 aaawhy 2026-04-03 10/500 2026-04-03 21:42 by lbsjt
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û