Znn3bq.jpeg
²é¿´: 979  |  »Ø¸´: 4

dyc_2008

¾èÖú¹ó±ö (ÖøÃûдÊÖ)

[½»Á÷] ¡¾ÇóÖú¡¿Ð³æÊ¹ÓÃVASP¡£ÇëÎÊÔõÑùÉèÖÃPOTCARÖеÄÔ­×Ó×ø±ê°¡£¿ ÒÑÓÐ4È˲ÎÓë

¿´Á˰ëÌìʹÓÃÊֲᣬ¾ÍÊǸ㲻¶®ÄǸöÔ­×Ó×ø±êÄÄÀïÀ´µÄ¡£²»»áÒª×Ô¼º×öʵÑéÀ´µÃµ½°Ñ¡£
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

Ò»²¼¸£Ì¶þÐÞÆÐÌá
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

condensed

ľ³æ (ÖøÃûдÊÖ)

¡ï
hedaors(½ð±Ò+1):thanks 2010-06-24 16:55:56
POSCAR...POTCARÊÇÊÆÎļþ.

Ô­×Ó×ø±ê×ÔÈ»ÊÇ´ÓÒÑÖª½á¹¹»òÕßÎÄÏ×ÀïÃæµÃµ½µÄ.
2Â¥2010-06-24 15:41:44
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

chuchu6816

½ð³æ (ÕýʽдÊÖ)

¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
hedaors(½ð±Ò+1):¸Ðл½»Á÷ 2010-06-24 16:56:05
MS ÀïÃæ£¬castep ±£´æ cell
ÀïÃæÖ±½Ó¸´ÖÆ
3Â¥2010-06-24 15:49:03
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

fanchen021

Ìú¸Ëľ³æ (ÕýʽдÊÖ)

¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
ÎÊÎÊʦÐÖʦ½ãÃǰɡ£¡£¡£
4Â¥2010-06-24 16:07:49
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

qiqi2926

Í­³æ (СÓÐÃûÆø)

¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
hedaors(½ð±Ò+1):¸Ðл½»Á÷ 2010-06-24 16:56:16
ÒýÓûØÌû:
Originally posted by dyc_2008 at 2010-06-24 15:04:42:
¿´Á˰ëÌìʹÓÃÊֲᣬ¾ÍÊǸ㲻¶®ÄǸöÔ­×Ó×ø±êÄÄÀïÀ´µÄ¡£²»»áÒª×Ô¼º×öʵÑéÀ´µÃµ½°Ñ¡£

Ê×ÏÈÔ´×ÔµÄ×ø±ê²»ÔÙPOTCARÀïÃæ£¬¶øÔÚPOSCARÀïÃæ¡£
¶øÕâЩԭ×ÓµÄ×ø±êÒ»°ãÊǸù¾ÝʵÑéÎÄÏ×ÀïµÄÊý¾Ý£¬¸ù¾Ý¿Õ¼äȺºÍÒÑÖªÔ­×ÓµÄ×ø±ê¹¹½¨³öÀ´µÄ£¬Õâ¸ö¿ÉÒÔÀûÓÃMS¡£
ҪעÒâ¶à²éÏà¹ØÎÄÏס£¿ÉÒÔÕÒµ½ÄãÏëÒªµÄÊý¾Ý
5Â¥2010-06-24 16:34:06
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ dyc_2008 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 284Çóµ÷¼Á +7 archer.. 2026-04-09 8/400 2026-04-09 21:30 by bljnqdcc
[¿¼ÑÐ] 278Çóµ÷¼Á +27 ·¶æÃÄÈ 2026-04-07 31/1550 2026-04-09 20:49 by zhouxiaoyu
[¿¼ÑÐ] ¿¼Ñе÷¼Á-²ÄÁÏÀà-284 +28 Ïë»»ÊÖ»ú²»Ïë½âÊ 2026-04-08 28/1400 2026-04-09 20:08 by µ¹Êý321?
[¿¼ÑÐ] ¼ÆËã»ú11408£¬286·ÖÇóµ÷¼Á +9 ľ×ÓÄî•„ 2026-04-05 9/450 2026-04-09 20:04 by vgtyfty
[¿¼ÑÐ] 308Çóµ÷¼Á +17 īīĮ 2026-04-06 17/850 2026-04-09 09:25 by Ò¼ÍùŸoǰ
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +14 Ò»ÑùYWY 2026-04-06 14/700 2026-04-08 23:00 by Öí»á·É
[¿¼ÑÐ] 288»·¾³×¨Ë¶,Çóµ÷²ÄÁÏ·½Ïò +35 lllllos 2026-04-04 39/1950 2026-04-07 23:24 by Ò»Ö»ºÃ¹û×Ó?
[¿¼ÑÐ] 259Çóµ÷¼Á +5 ¾Í°®³ÔÍÁ¶¹Ñ½Ñ½ 2026-04-07 5/250 2026-04-07 22:40 by JourneyLucky
[¿¼ÑÐ] ÉúÎ﹤³ÌÇóµ÷¼Á +13 ϲ»¶»¹ÊDz»¸ÊÐÄ 2026-04-05 13/650 2026-04-07 16:55 by Ecowxq666£¡
[¿¼ÑÐ] 295Çóµ÷¼Á +18 xndjjj 2026-04-04 19/950 2026-04-07 11:02 by wangjy2002
[¿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] ²ÄÁϵ÷¼Á +14 Ò¼·¡·¡ÒÚ 2026-04-04 14/700 2026-04-05 23:31 by À´¿´Á÷ÐÇÓê10
[¿¼ÑÐ] ÉúÎïѧ308·ÖÇóµ÷¼Á£¨Ò»Ö¾Ô¸»ª¶«Ê¦´ó£© +8 ÏàÐűػá¹ââÍòÕ 2026-04-05 10/500 2026-04-05 12:19 by Hdyxbekcb
[¿¼ÑÐ] ¿¼Ñе÷¼Á +3 mcbbc 2026-04-04 3/150 2026-04-05 10:03 by barlinike
[¿¼ÑÐ] 11408,335·Ö£¬±¾¿Æ211£¬Çóµ÷¼Á£¬¿Éתרҵ +5 öùÀæ´óöùÓã 2026-04-03 5/250 2026-04-04 22:49 by chongya
[¿¼ÑÐ] ¿¼Ñе÷¼Á +5 ËÄ´¨ÍõÌÎ 2026-04-04 5/250 2026-04-04 22:18 by à£à£à£0119
[¿¼ÑÐ] 283·ÖÇóµ÷¼Á +7 СÄô°®Ñ§Ï° 2026-04-03 7/350 2026-04-04 21:51 by hemengdong
[¿¼ÑÐ] һ־Ը˫·Ç085502£¬267·Ö£¬¹ýËļ¶Çóµ÷¼Á +3 ÔÙæҲҪ³Ô·¹°¡ 2026-04-03 3/150 2026-04-04 05:03 by gswylq
[¿¼ÑÐ] 338Çóµ÷¼Á +4 zzz£¬£¬r 2026-04-03 4/200 2026-04-03 16:39 by lijunpoly
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û