Znn3bq.jpeg
²é¿´: 2210  |  »Ø¸´: 7

duoruimi

Òø³æ (СÓÐÃûÆø)

[ÇóÖú] ÔõÑù½«vasp¼ÆËãµÄƵÂÊÁгöÀ´

¸÷λºÃ£º
    ÓÃʲôºÃ°ì·¨Äܽ«vasp¼ÆËãµÄƵÂÊÁÐÔÚexcelÀ¶ø²»ÓÃÒ»Ò»copy£¨1fÊǶàÉÙÊäÈëexcel£¬2fÊǶàÉÙÊäÈëexcel¡£¡£¡£200f¡£¡£¡££©¡£Ð»Ð»£¡
»Ø¸´´ËÂ¥

» ÊÕ¼±¾ÌûµÄÌÔÌûר¼­ÍƼö

VASP

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

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

uuv2010

ÈÙÓþ°æÖ÷ (Ö°Òµ×÷¼Ò)

ÓÅÐã°æÖ÷

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¡ï
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
WDD880227(½ð±Ò+1): ¸Ðл½»Á÷Ìáʾ 2012-03-05 14:26:08
grep f/    OUTCAR >vib.dat
½«ËùÓÐÆµÂÊÊä³öµ½vib.datÖУ¬È»ºóµ¼ÈëexcelÖÐ
2Â¥2012-03-05 14:17:49
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

llhhvhnh

½û³æ (СÓÐÃûÆø)

¡ï
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
liliangfang(½ð±Ò+1): ¹ÄÀø½»Á÷ 2012-03-06 10:39:52
±¾ÌûÄÚÈݱ»ÆÁ±Î

3Â¥2012-03-06 09:14:44
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

uuv2010

ÈÙÓþ°æÖ÷ (Ö°Òµ×÷¼Ò)

ÓÅÐã°æÖ÷

ÒýÓûØÌû:
3Â¥: Originally posted by llhhvhnh at 2012-03-06 09:14:44:
ÄúºÃ£¬ÎÒÊÔÁËһϣ¬vib.datÀï³ö²»ÁËÎȶ¨ÌåµÄƵÂÊ£¬¶ø¹ý¶Éֻ̬ÁгöÀ´Ð鯵¡£ÊÇÕâÑùµÄÂð£¬Ð»Ð»¡£

ʲôÒâ˼£¿£¬Ã»¿´Ã÷°×
4Â¥2012-03-06 09:17:56
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

chimegreen

ľ³æ (ÕýʽдÊÖ)

Dr.

ÒýÓûØÌû:
3Â¥: Originally posted by llhhvhnh at 2012-03-06 09:14:44:
ÄúºÃ£¬ÎÒÊÔÁËһϣ¬vib.datÀï³ö²»ÁËÎȶ¨ÌåµÄƵÂÊ£¬¶ø¹ý¶Éֻ̬ÁгöÀ´Ð鯵¡£ÊÇÕâÑùµÄÂð£¬Ð»Ð»¡£

ºÇºÇ£¬¶þÂ¥ÒѾ­»Ø´ðÁËÂ¥Ö÷µÄÎÊÌ⣬ÄãÕâÊǸöÐÂÎÊÌ⣬Ӧ¸ÃÐðÊöÏêϸЩ¡£
¿ìÀÖ¿ÆÑУ¬¿ìÀÖÉú»î¡£
5Â¥2012-03-06 10:07:58
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

llhhvhnh

½û³æ (СÓÐÃûÆø)

±¾ÌûÄÚÈݱ»ÆÁ±Î

6Â¥2012-03-06 14:45:40
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

uuv2010

ÈÙÓþ°æÖ÷ (Ö°Òµ×÷¼Ò)

ÓÅÐã°æÖ÷

¡ï
liliangfang(½ð±Ò+1): ¶àлָ½Ì 2012-03-06 14:54:11
ÒýÓûØÌû:
6Â¥: Originally posted by llhhvhnh at 2012-03-06 14:45:40:
¾ÍÊÇÕâÐÐÊÇÔÚʲôµØ·½¼ÓµÄ£¬INCARÀïÂ𣬻¹ÊÇÖ´ÐÐÕâ¸öÃüÁî¡£²»Ì«Ã÷°×£¬ÄÜ˵µÄϸµãÂð£¬Ð»Ð»¡£
grep f/    OUTCAR >vib.dat

ÕâÖ»Êǽ«OUTCARÖÐµÄÆµÂÊÌô³öÀ´£¬ºÍ¼ÆËãû¹ØÏµ
7Â¥2012-03-06 14:47:53
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

llhhvhnh

½û³æ (СÓÐÃûÆø)

±¾ÌûÄÚÈݱ»ÆÁ±Î

8Â¥2012-03-06 14:59:13
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ duoruimi µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] Ò»Ö¾Ô¸Î÷±±¹¤Òµ´óѧ289 085602 +31 yangæÃ 2026-04-10 31/1550 2026-04-11 00:19 by gong120082
[¿¼ÑÐ] 296Çóµ÷¼Á +11 Íô£¡£¿£¡ 2026-04-10 13/650 2026-04-10 23:16 by Ftglcn90
[¿¼ÑÐ] 263ÄÜÔ´¶¯Á¦×¨Ë¶Çóµ÷¼Á +3 ¼Ó´óºÅ·¹ºÐ´ü 2026-04-10 3/150 2026-04-10 22:23 by 286640313
[¿¼ÑÐ] Çóµ÷¼Á +5 ²»»á·ÉµÄÓã@ 2026-04-10 5/250 2026-04-10 19:07 by chemisry
[¿¼ÑÐ] 301Çóµ÷¼Á +5 149. 2026-04-10 5/250 2026-04-10 15:45 by ²ñС°×
[¿¼ÑÐ] ½­ËÕ´óѧ ¹¤¿Æµ÷¼Á ¼ñ© +3 Evan_Liu 2026-04-09 5/250 2026-04-10 10:22 by Evan_Liu
[¿¼ÑÐ] ²ÄÁÏר˶283Çóµ÷¼Á +18 ÊÔÊÔ¿´ß 2026-04-04 19/950 2026-04-10 10:05 by may_ÐÂÓî
[¿¼ÑÐ] ²ÄÁÏר˶(0856) 339·ÖÇóµ÷¼Á +11 ¹þ¹þ¹þ¶ì¹þ¹þ¹þ 2026-04-04 11/550 2026-04-10 09:37 by 690616278
[¿¼ÑÐ] 085601³õÊÔ330·ÖÕÒµ÷¼Á +10 Á÷ÐÄÄ̻ưül 2026-04-09 10/500 2026-04-10 08:14 by Sammy2
[¿¼ÑÐ] 269Çóµ÷¼Á +7 ¹òÇóÊÕÁô¡£ 2026-04-04 7/350 2026-04-09 19:06 by ̽123
[¿¼ÑÐ] 085501»úеӢ¶þ77×Ü·Ö294Çóµ÷¼Á£¬½ÓÊÜ¿çרҵѧϰ +6 ÊØ·¨¹«ÃñØÁ¼Í 2026-04-08 6/300 2026-04-09 15:55 by wp06
[¿¼ÑÐ] 086000ÉúÎïÓëÒ½Ò©µ÷¼Á +7 awwwwwooooo 2026-04-09 7/350 2026-04-09 13:31 by ±±¼«159263
[¿¼²©] ²ÄÁÏ·½Ïò¿¼²©£¬ÇóÍÆ¼ö +3 ÑÔÓïaaa 2026-04-05 4/200 2026-04-08 22:22 by nxgogo
[¿¼ÑÐ] 285Çóµ÷¼Á +7 ¶ñ·¨´ó¶þµÄÆøÎ¶ß 2026-04-05 10/500 2026-04-08 14:34 by zhq0425
[¿¼ÑÐ] 277¹¤¿ÆÇóµ÷¼Á +10 1915668 2026-04-04 11/550 2026-04-06 23:53 by ÐÄæÂÒâ±±
[¿¼ÑÐ] »úеר˶274Çóµ÷¼Á£¬²»ÌôרҵѧУ +6 ·º·º2333 2026-04-05 8/400 2026-04-06 18:06 by ·º·º2333
[¿¼ÑÐ] ²ÄÁÏר˶322·Ö +10 ¹þ¹þ¹þºðºðºð¹þ 2026-04-04 10/500 2026-04-05 21:22 by ѧԱ8dgXkO
[¿¼ÑÐ] Ò»Ö¾Ô¸±±¾©½»Í¨´óѧ²ÄÁϹ¤³Ì×Ü·Ö358Çóµ÷¼Á +4 cs0106 2026-04-04 4/200 2026-04-05 18:46 by imissbao
[¿¼ÑÐ] ¹¤¿Æ277·ÖÇóµ÷¼Á²ÄÁÏ +8 ÉÏÁËÉÏÁËÉÏŶ 2026-04-05 9/450 2026-04-05 13:05 by wwytracy
[¿¼ÑÐ] 316Çóµ÷¼Á +9 Ä«³½_Orion926 2026-04-04 9/450 2026-04-04 21:35 by lbsjt
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û