Znn3bq.jpeg
²é¿´: 266  |  »Ø¸´: 2
µ±Ç°Ö÷ÌâÒѾ­´æµµ¡£
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

wuchenwf

ÈÙÓþ°æÖ÷ (Ö°Òµ×÷¼Ò)

[½»Á÷] ¡¾ÇóÖú¡¿ÇóÖú¹ØÓÚ VASPµÄÁ½¸öÎÊÌâ лл¸÷λǰ±²

¸÷λ ǰ±² СµÜÎÒÓÐ Á½¸ö ¹ØÓÚ ÎÊÌâ  Ïò ¸÷λ Ìֽ̠ »¹Çë ¸÷λ ´Í½Ì
1  Äܲ»ÄÜ ÔÚVASPµÄ¼ÆËãǰ »òÕß¼ÆËãµÄ¹ý³ÌÖР ´óÖ ¹À¼Æ³öÀ´ ÔËÐÐ ÐèÒªµÄ ʱ¼ä
2  ÎÒ¼ÆËãÁËһϠ±ðÈË ±àдµÄ ¼ÆËã ³ÌÐò  ·¢ÏÖ ½á¹û ²îµÄºÜ´ó  ÄÜÁ¿ ËûËãµÃµ½µÄÊÇ20ev  ¶øÎҵõ½µÄÊÇ25ev  ÕâҲ̫´óÁË  ÊDz»ÊÇ ÎÒ°²×°³öÏÖÁËÎÊÌâ ¿ÉÊÇ ÎÒÔËÐР  benchʲôµÄ  Ã»ÓÐʲô ´íÎó°¡
Çë ¸÷λ ´Í½Ì лл¸÷λ

[ Last edited by wuchenwf on 2009-6-21 at 19:59 ]
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

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

zhuly

Òø³æ (СÓÐÃûÆø)

¡ï ¡ï ¡ï
csfn(½ð±Ò+2,VIP+0):thanks~
wuchenwf(½ð±Ò+1):лл O(¡É_¡É)O 1-26 12:37
ÓÃbenchmark²âÊÔÒ»ÏÂ,¿´¿´½á¹ûºÍbenchmark½á¹ûÓжà´óµÄ²îÒì,ÎÒ֮ǰÓÃpgiºÍgotoµÄ¿â±àÒë³öÀ´µÄºÍifortºÍMKL¿â±àÒë³öÀ´µÄ½á¹û²î±ðÒ²ºÜ´ó
3Â¥2008-03-17 10:30:28
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 3 ¸ö»Ø´ð

wyl04

½ð³æ (СÓÐÃûÆø)

¡ï ¡ï ¡ï
lei0736(½ð±Ò+2,VIP+0):лл·ÖÎö½â´ð
wuchenwf(½ð±Ò+1):лл O(¡É_¡É)O 1-26 12:37
ÒýÓûØÌû:
Originally posted by wuchenwf at 2008-3-16 21:45:
¸÷λ ǰ±² СµÜÎÒÓÐ Á½¸ö ¹ØÓÚ ÎÊÌâ  Ïò ¸÷λ Ìֽ̠ »¹Çë ¸÷λ ´Í½Ì
1  Äܲ»ÄÜ ÔÚVASPµÄ¼ÆËãǰ »òÕß¼ÆËãµÄ¹ý³ÌÖР ´óÖ ¹À¼Æ³öÀ´ ÔËÐÐ ÐèÒªµÄ ʱ¼ä
2  ÎÒ¼ÆËãÁËһϠ±ðÈË ±àдµÄ ¼ÆËã ³ÌÐò  ·¢ÏÖ ½á¹û ²îµÄºÜ´ó ...

1.Äã¿ÉÒÔÆ¾¾­Ñé¹ÀË㡣׼ȷʱ¼ä²»ÄÜÖªµÀ
2¡£ÄãÃÇÈ¡µÃ²ÎÊý¡¢ÊÆ¡¢KPOINTS.INCAR,POTCARÊÇ·ñÒ»Ñù£ºÈôÒ»Ñù£¬²»»áÓÐÕâô´óµÄ²î±ð£»²»Ò»Ñù£¬²î±ð»áÓе쬵«²î20%µ¹ÉÙ¼û¡£
2Â¥2008-03-17 10:17:24
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] Ò»Ö¾Ô¸211µç×ÓÐÅÏ¢347Çóµ÷¼Á +3 554916 2026-04-03 4/200 2026-04-09 22:24 by 554916
[¿¼ÑÐ] Ò»Ö¾Ô¸085502£¬267·ÖÇóµ÷¼Á +10 ÔÙæҲҪ³Ô·¹°¡ 2026-04-08 11/550 2026-04-09 19:51 by gong120082
[¿¼ÑÐ] 0703»¯Ñ§µ÷¼Á325·Ö +13 15771691647 2026-04-04 15/750 2026-04-09 16:55 by 15771691647
[¿¼ÑÐ] 083200 ³õÊÔ305·Ö Çóµ÷¼Á Ôݲ»¿¼ÂÇ¿çרҵ +15 Claireyyyy 2026-04-09 15/750 2026-04-09 16:11 by zhuimr
[¿¼ÑÐ] ²ÄÁϹ¤³Ì322 +18 ¹þ¹þ¹þºðºðºð¹þ 2026-04-07 19/950 2026-04-09 10:44 by cymywx
[¿¼ÑÐ] ²ÄÁÏ¿ÆÑ§Ó빤³Ì320Çóµ÷¼Á£¬080500 +12 »Æ¹ÏζÊíÆ¬ 2026-04-06 12/600 2026-04-08 16:26 by luoyongfeng
[¿¼ÑÐ] 316Çóµ÷¼Á +4 15318418673 2026-04-07 4/200 2026-04-07 22:12 by hemengdong
[¿¼ÑÐ] 26×ÔÈ»µØÀíѧ303·ÖÇóµ÷¼Á +4 Ò»Õ½³É˶°¡°¡°¡° 2026-04-06 9/450 2026-04-06 20:35 by lin-da
[¿¼ÑÐ] 081200-11408-276ѧ˶Çóµ÷¼Á +5 ´Þwj 2026-04-05 5/250 2026-04-06 15:40 by lin-da
[¿¼ÑÐ] Çóµ÷¼Á +11 xzghyuj 2026-04-04 11/550 2026-04-06 11:49 by lijunpoly
[¿¼ÑÐ] ¹¤¿Æ370Çóµ÷¼Á +3 äçÐļ弦µ° 2026-04-05 3/150 2026-04-06 10:55 by ÕâÊÇÒ»¸öÎÞÁĵÄê
[¿¼ÑÐ] µÚÒ»Ö¾Ô¸¶«ÄÏ´óѧÎïÀí313£¬ÓпÆÑоºÈü»ñ½±¾­Àú£¬Ï£ÍûÎïÀí¸´ÊÔµ÷¼Á +3 ÂíÄÚ³È 2026-04-05 3/150 2026-04-06 10:32 by À¶ÔÆË¼Óê
[¿¼ÑÐ] ²ÄÁÏר˶322·Ö +10 ¹þ¹þ¹þºðºðºð¹þ 2026-04-04 10/500 2026-04-05 21:22 by ѧԱ8dgXkO
[¿¼ÑÐ] ÉúÎïÓëÒ½Ò©µ÷¼Á +4 Ê®Æßsa 2026-04-05 4/200 2026-04-05 20:05 by lys0704
[¿¼ÑÐ] ¹¤¿Æ277·ÖÇóµ÷¼Á²ÄÁÏ +8 ÉÏÁËÉÏÁËÉÏŶ 2026-04-05 9/450 2026-04-05 13:05 by wwytracy
[¿¼ÑÐ] Ò»Ö¾Ô¸»¦9£¬ÇóÉúÎïѧµ÷¼Á£¬326·Ö +6 Áõīī 2026-04-04 6/300 2026-04-04 19:44 by ÌÆãå¶ù
[¿¼ÑÐ] 272Çóµ÷¼Á +4 Ëɰس£Çà5 2026-04-03 4/200 2026-04-04 17:03 by babysonlkd
[¿¼ÑÐ] 372·Ö²ÄÁÏÓ뻯¹¤£¨085600£©Ò»Ö¾Ô¸ºþÄÏ´óѧÇóµ÷¼Á +3 À¶¼ãƬ 2026-04-03 4/200 2026-04-03 17:58 by Jimmyandyou
[¿¼ÑÐ] 315Çóµ÷¼Á +6 ˳Àí³ÉÕÅ 2026-04-03 8/400 2026-04-03 14:04 by °ÙÁéͯ888
[¿¼ÑÐ] Çó²ÄÁϵ÷¼Á Ò»Ö¾Ô¸Äϲý´óѧ 328·Ö +5 yyy..... 2026-04-03 5/250 2026-04-03 13:46 by °ÙÁéͯ888
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û