±±¾©Ê¯ÓÍ»¯¹¤Ñ§Ôº2026ÄêÑо¿ÉúÕÐÉú½ÓÊÕµ÷¼Á¹«¸æ
²é¿´: 7926  |  »Ø¸´: 27
±¾Ìû²úÉú 1 ¸ö 1STÇ¿Ìû £¬µã»÷ÕâÀï½øÐв鿴

chenxin1992

Òø³æ (ÕýʽдÊÖ)

¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
ÒýÓûØÌû:
3Â¥: Originally posted by huangll99 at 2012-07-19 08:08:23
ÄÇÎÒҲ˵¸ö°ì·¨£¬´ÓMSÖе¼³öCIFÎļþ£¬ÓÃVESTA°ÑCIFÎļþת»»³É.vasp¸ñʽ£¬¾ÍÊÇPOSCARÁË

µ¼³öÀ´ºó£¬ÔÚVESTAÖÐûÓмü
11Â¥2012-08-28 23:00:54
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

cenwanglai

ÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)

ÀϺÍɽâ«ËöÅɾŶÎ

ÓÅÐã°æÖ÷

¡ï ¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
fzx2008: ½ð±Ò+1, ллָ½Ì£¡ 2012-08-29 13:08:51
ÒýÓûØÌû:
11Â¥: Originally posted by chenxin1992 at 2012-08-28 23:00:54
µ¼³öÀ´ºó£¬ÔÚVESTAÖÐûÓмü...

û¼ü£¬Ã»¹ØÏµ¡£Ö»ÊÇÏÔʾ¸øÄã¿´¿´£¬ÓÖ²»Ó°Ïì¼ÆËã¡£

¿ÉÒÔÔÙVESTAÖе÷³ö¼üÀ´¡£
12Â¥2012-08-29 08:44:50
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

chenxin1992

Òø³æ (ÕýʽдÊÖ)

¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
ÒýÓûØÌû:
12Â¥: Originally posted by cenwanglai at 2012-08-29 08:44:50
û¼ü£¬Ã»¹ØÏµ¡£Ö»ÊÇÏÔʾ¸øÄã¿´¿´£¬ÓÖ²»Ó°Ïì¼ÆËã¡£

¿ÉÒÔÔÙVESTAÖе÷³ö¼üÀ´¡£...

ÎÒ¸Õ¸Õѧ»á£¬¼ûЦÁË£¬ÕýÔÚΪÈçºÎ»æÖÆDOS£¬ÄÜ´øÍ¼¶ø·¸³îÄØ¡¢
13Â¥2012-08-29 12:31:07
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

cenwanglai

ÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)

ÀϺÍɽâ«ËöÅɾŶÎ

ÓÅÐã°æÖ÷

¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
ÒýÓûØÌû:
13Â¥: Originally posted by chenxin1992 at 2012-08-29 12:31:07
ÎÒ¸Õ¸Õѧ»á£¬¼ûЦÁË£¬ÕýÔÚΪÈçºÎ»æÖÆDOS£¬ÄÜ´øÍ¼¶ø·¸³îÄØ¡¢...

ÕâЩ¶¼ÊÇÃ÷°Ú×ŵÄÎÊÌ⣬¼á³Ö²»Ð¸£¬Ò»ÖÜ×óÓҾͻáŪÇå³þÁË¡£
14Â¥2012-08-29 13:24:50
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

chenxin1992

Òø³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
14Â¥: Originally posted by cenwanglai at 2012-08-29 13:24:50
ÕâЩ¶¼ÊÇÃ÷°Ú×ŵÄÎÊÌ⣬¼á³Ö²»Ð¸£¬Ò»ÖÜ×óÓҾͻáŪÇå³þÁË¡£...

лл°ßÖñ
15Â¥2012-08-29 22:52:09
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
16Â¥2012-08-30 18:19:48
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

707462558

Òø³æ (ÖøÃûдÊÖ)

¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
ÒýÓûØÌû:
3Â¥: Originally posted by huangll99 at 2012-07-19 08:08:23
ÄÇÎÒҲ˵¸ö°ì·¨£¬´ÓMSÖе¼³öCIFÎļþ£¬ÓÃVESTA°ÑCIFÎļþת»»³É.vasp¸ñʽ£¬¾ÍÊÇPOSCARÁË

ÄãºÃ  ÓÃVESTA°ÑCIFÎļþת»»³É.vasp¸ñʽÊÇÔõô½øÐеÄÄØ
ÎÞÂÛÉú»îºÍÄ㿪Á˶à´óµÄÍæÐ¦ÎÒÃǶ¼µÃ¼ÌÐøÉú»î
17Â¥2012-12-11 22:37:05
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

huangll99

ľ³æ (Ö°Òµ×÷¼Ò)

¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
ÒýÓûØÌû:
17Â¥: Originally posted by 707462558 at 2012-12-11 22:37:05
ÄãºÃ  ÓÃVESTA°ÑCIFÎļþת»»³É.vasp¸ñʽÊÇÔõô½øÐеÄÄØ...

file-export data Ñ¡VASP¸ñʽ¾ÍºÃÁË

» ±¾ÌûÒÑ»ñµÃµÄºì»¨£¨×îÐÂ10¶ä£©

18Â¥2012-12-12 09:33:00
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

707462558

Òø³æ (ÖøÃûдÊÖ)

¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
ËÍÏÊ»¨Ò»¶ä
ÒýÓûØÌû:
18Â¥: Originally posted by huangll99 at 2012-12-12 09:33:00
file-export data Ñ¡VASP¸ñʽ¾ÍºÃÁË...

лл  ÕæÓÐÓà ËÍÄãÒ»¶ä»¨°É
ÎÒµÄqq  707462558 ÎÒºÍÄãרҵһÑù ¼ÓÒ»ÏÂÎÒ°É
ÎÞÂÛÉú»îºÍÄ㿪Á˶à´óµÄÍæÐ¦ÎÒÃǶ¼µÃ¼ÌÐøÉú»î
19Â¥2012-12-12 12:52:49
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

xianxianlu

Í­³æ (СÓÐÃûÆø)

¡ï
Сľ³æ: ½ð±Ò+0.5, ¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
Æäʵ°ÑCIFÎļþ£¬CELLÎļþµÈת»»³ÉPOSCARÎļþÏ൱¼òµ¥£¬ÍƼöʹÓÃÔÚÏßVASP¹¤¾ßÏä
http://www.scicloud.co/model/vasp
¼È¿ÉÒÔ°ÑcifÎļþתΪPOSCARÎļþ£¬Ò²¿ÉÒÔ°ÑPOSCARÎļþת»»ÎªcifÎļþ£¬²¢¿ÉÒÔÔÚÏßͨ¹ýjmol²é¿´POSCARµÄ½á¹¹¡£
Á¿×Ó»¯Ñ§Óë¼ÆË㻯ѧ
20Â¥2012-12-15 20:23:10
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ gyldmy µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] ±¾¿Æ211£¬293·ÖÇëÇóµ÷¼Á +6 Á«²Ë¾ÍÊÇź°É 2026-04-03 7/350 2026-04-04 11:12 by Á«²Ë¾ÍÊÇź°É
[¿¼ÑÐ] Ò»Ö¾Ô¸ÉϺ£º£Ñó´óѧ083200ʳƷѧ˶£¬Çóµ÷¼Á£¬½ÓÊÜÆäËûרҵ083200 +3 whatÕÅ 2026-04-04 4/200 2026-04-04 09:50 by rzh123456
[¿¼ÑÐ] 320·ÖÈ˹¤ÖÇÄܵ÷¼Á +6 Õñ¡ªTZ 2026-04-03 6/300 2026-04-04 01:05 by Dream007008
[¿¼ÑÐ] 283·Ö²ÄÁÏÓ뻯¹¤Çóµ÷¼Á +29 ÂÞKAKA 2026-04-02 29/1450 2026-04-03 23:56 by userper
[¿¼ÑÐ] ÉúÎïѧ308·ÖÇóµ÷¼Á£¨Ò»Ö¾Ô¸»ª¶«Ê¦´ó£© +7 ÏàÐűػá¹ââÍòÕ 2026-04-02 7/350 2026-04-03 16:48 by rzh123456
[¿¼ÑÐ] »¯Ñ§µ÷¼Á +9 °¬Ö¾ºã 2026-04-03 10/500 2026-04-03 15:51 by Çç¿Õ210210
[¿¼ÑÐ] 285Çóµ÷¼Á +6 FZAC123 2026-03-30 6/300 2026-04-03 12:22 by xingguangj
[¿¼ÑÐ] 312Çóµ÷¼Á +4 ÉÞÔÂÉ« 2026-04-02 5/250 2026-04-03 08:21 by fangshan711
[¿¼ÑÐ] Ò»Ö¾Ô¸±±¾©¿Æ¼¼²ÄÁÏ¿ÆÑ§Ó빤³Ì288·Ö£¬Çóµ÷¼Á +14 Êdz½°¡ 2026-04-02 14/700 2026-04-02 21:10 by dongzh2009
[¿¼ÑÐ] Çóµ÷¼Á 302·Ö³õÊÔ 0854 +5 Áæ¿ÉÀÖ 2026-04-02 5/250 2026-04-02 17:53 by ±ÊÂä½õÖÝ
[¿¼ÑÐ] 283Çóµ÷¼Á +3 jiouuu 2026-04-02 4/200 2026-04-02 14:08 by ßÕßÕßÕßÉßÉßÉ
[¿¼ÑÐ] 085601Ò»Ö¾Ô¸ÖÐɽ´óѧÉîÛÚ²ÄÁϹ¤³Ì330Çóµ÷¼Á +8 pipiver 2026-03-30 8/400 2026-04-02 12:01 by ms629
[¿¼ÑÐ] ²ÄÁÏÇóµ÷¼Á +10 ÄØÄØÄÝÄÝ 2026-04-01 13/650 2026-04-02 09:17 by olim
[¿¼ÑÐ] 296Çóµ÷¼Á +4 Íô£¡£¿£¡ 2026-03-31 7/350 2026-04-01 22:04 by ¿Í¶ûÃÀµÂ
[¿¼ÑÐ] Çóµ÷¼Á +4 DADA¹Ö 2026-03-31 4/200 2026-04-01 14:30 by ZXlzxl0425
[¿¼ÑÐ] ÍÁľ304Çóµ÷¼Á +3 ÍÃͻͻͻ£¬ 2026-03-31 3/150 2026-04-01 09:42 by JourneyLucky
[¿¼ÑÐ] 254²ÄÁÏÓ뻯¹¤Çóµ÷¼Á +3 º²¶¬ÁÖéª 2026-03-30 4/200 2026-03-31 17:53 by yishunmin
[¿¼ÑÐ] ½­ËÕËÕ±±¸ßУ³ÏÑûµ÷¼Áͬѧ +3 zzll406 2026-03-31 3/150 2026-03-31 16:54 by ¼°Ê±ÐÐÀÖfan
[¿¼ÑÐ] 313Çóµ÷¼Á +6 Âô¸ö¹Ø×Ó°É 2026-03-31 6/300 2026-03-31 10:58 by Jaylen.
[¿¼ÑÐ] 085602 »¯Ñ§¹¤³Ìר˶ 340·ÖÇóµ÷¼Á +4 qianbai11 2026-03-29 4/200 2026-03-30 11:34 by ÌÆãå¶ù
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û