Znn3bq.jpeg
ÉÇÍ·´óѧº£Ñó¿ÆÑ§½ÓÊܵ÷¼Á
²é¿´: 4147  |  »Ø¸´: 11

ocean08

ľ³æ (ÖøÃûдÊÖ)

×öÈËÒª¿ªÐÄ

[½»Á÷] ¡¾ÇóÖú¡¿Castep¼ÆËãÖжÏÈçºÎ½øÐÐÐøË㣿 ÒÑÓÐ3È˲ÎÓë

Castep¼ÆËãÖжÏÈçºÎ½øÐÐÐøË㣿

[ Last edited by aylayl08 on 2010-3-17 at 08:37 ]
»Ø¸´´ËÂ¥

» ÊÕ¼±¾ÌûµÄÌÔÌûר¼­ÍƼö

Ä£Äâ֪ʶ»ã×Ü

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

ÒÔÒ»ÎÞËùÖªºÍÎÞËù²»ÖªµÄ·½Ê½È¥Ë¼¿¼£»ÒÔ¼´½«¸°ËÀºÍÓÀÉú²»ËÀµÄ̬¶ÈÈ¥Éú»î¡£
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

css8170

ľ³æ (ÕýʽдÊÖ)

¡ï ¡ï ¡ï ¡ï
ocean08(½ð±Ò+4,VIP+0):лл£¬ÎÒµÄÊǶϵçÁË£¬°¥£¬Ö»ÄÜ´ÓÍ·ËãÁË
´ò¿ªÊäÈëÎļþ*.param£¬¼ÓÈëÒÔÏÂÐУº
CONTINUATION : default
ÔÚ¸ÃÎļþ´ò¿ªµÄÇé¿öÏ£¬ÔÚCASTEP Calculaiton¶Ô»°¿òÖеã»÷
Files -> Run Files
³öÏÖSave File£¿
Ñ¡ÔñYes£¬¼´¿É¿ªÊ¼¼ÆËã¡£
ÖØÐ¼ÆËãʱ£¬±ØÐëÓÐ*.checkÎļþ£¬¼ÆËãÖгöÏֶϵçµÈÏÖÏóʱ£¬¸ÃÎļþÒòÇ¿ÐÐÖÐÖ¹¼ÆËã¶øÔâµ½ÆÆ»µ£¬ÕâÖÖÇé¿öϾͲ»ÄÜÖØÐ¿ªÊ¼¼ÆËã¡£
2Â¥2009-01-15 21:00:23
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

xmc8362

Òø³æ (ÕýʽдÊÖ)

¡ï
ocean08(½ð±Ò+1,VIP+0):лл
µ¥»ú¼ÆËã¶ÏµçÐøËã¿ÖŲ»ÐÐ.
3Â¥2009-01-15 21:52:05
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ÐÄÄþ

½ð³æ (ÕýʽдÊÖ)

¡ï ¡ï
wuchenwf(½ð±Ò+2):xiexieÌÖÂÛ 1-18 21:06
µ¥»ú¼ÆËã¶ÏµçÐøË㣺 ½«ÄãÓÅ»¯Ã»Íê³ÉµÄͼµã³öÀ´ ½Ó׿¸ºÎÓÅ»¯ ¾ÍÊÇÐøËã Õâ¸öÊÇwindowsϵÄŶ £¨ÎÒÊÔ¹ý   £©
Ö¾´æ¸ßÔ¶Ðë»ýºñÁ÷¹ã£­¼á³Ö²»Ð¸¶¨¶·×ªÐÇÒÆ£¡
4Â¥2009-01-17 10:05:25
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

xmc8362

Òø³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
Originally posted by ÐÄÄþ at 2009-1-17 10:05:
µ¥»ú¼ÆËã¶ÏµçÐøË㣺 ½«ÄãÓÅ»¯Ã»Íê³ÉµÄͼµã³öÀ´ ½Ó׿¸ºÎÓÅ»¯ ¾ÍÊÇÐøËã Õâ¸öÊÇwindowsϵÄŶ £¨ÎÒÊÔ¹ý   £©

¼ÆËãÆäËûÐÔÖÊʱÔõô°ì?
5Â¥2009-01-17 10:13:51
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ÐÄÄþ

½ð³æ (ÕýʽдÊÖ)

hehe

¡ï
wuchenwf(½ð±Ò+1):xiexieÌÖÂÛ 1-18 21:06
ÓÅ»¯³É¹¦ºó ÓÐÓÅ»¯ºÃµÄ»ú¹¹ÁË Ò»ÇкÍÒÔǰһÑùÁ˰¡

Ö¾´æ¸ßÔ¶Ðë»ýºñÁ÷¹ã£­¼á³Ö²»Ð¸¶¨¶·×ªÐÇÒÆ£¡
6Â¥2009-01-17 10:19:00
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

acridine

ľ³æ (ÕýʽдÊÖ)

¡ï ¡ï
wuchenwf(½ð±Ò+2):xiexieÌÖÂÛ 1-18 21:05
ÔÎŶ
¼´Ê¹µ¥»ú¼ÆËãÓÃ2Â¥µÄ·½·¨Ã»ÓÐÎÊÌâ°¡£¬¿ÉÒÔ½Ó×Å֮ǰµÄscf¼ÌÐø
×¢ÒâÄãÒªÊÇÓÃ¾É½á¹¹ÖØÐ¼ÆË㣬ÄÇôֻÊǽÓ×ÅʹÓÃ֮ǰµÄ½á¹¹£¬¶øscf×ÔÇ¢ÊÇÖØÐ¿ªÊ¼µÄ£»²ÉÓÃ2Â¥µÄ·½·¨ÄãÊǽÓ×Å֮ǰµÄ×ÔÇ¢¼ÌÐø½øÐУ¬Õâ²ÅÊÇÕæÕýµÄ¼ÌÐø¼ÆËã¡£
7Â¥2009-01-18 12:53:34
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

tanloer

½ð³æ (СÓÐÃûÆø)

¡ï
wuchenwf(½ð±Ò+1):ллÌÖÂÛ 1-21 20:01
ÒýÓûØÌû:
Originally posted by acridine at 2009-1-18 12:53:
ÔÎŶ
¼´Ê¹µ¥»ú¼ÆËãÓÃ2Â¥µÄ·½·¨Ã»ÓÐÎÊÌâ°¡£¬¿ÉÒÔ½Ó×Å֮ǰµÄscf¼ÌÐø
×¢ÒâÄãÒªÊÇÓÃ¾É½á¹¹ÖØÐ¼ÆË㣬ÄÇôֻÊǽÓ×ÅʹÓÃ֮ǰµÄ½á¹¹£¬¶øscf×ÔÇ¢ÊÇÖØÐ¿ªÊ¼µÄ£»²ÉÓÃ2Â¥µÄ·½·¨ÄãÊǽÓ×Å֮ǰµÄ×ÔÇ¢¼ÌÐø½øÐУ¬Õâ²ÅÊÇÕæÕýµÄ¼Ì ...

ͬÒ⣬ͬÒ⣡£¡£¡
8Â¥2009-01-20 23:49:29
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

astrolia

½û³æ (СÓÐÃûÆø)

¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
±¾ÌûÄÚÈݱ»ÆÁ±Î

9Â¥2010-11-29 10:46:29
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

bashen1

ÖÁ×ðľ³æ (СÓÐÃûÆø)

¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
ÒýÓûØÌû:
Originally posted by ÐÄÄþ at 2009-01-17 10:05:25:
µ¥»ú¼ÆËã¶ÏµçÐøË㣺 ½«ÄãÓÅ»¯Ã»Íê³ÉµÄͼµã³öÀ´ ½Ó׿¸ºÎÓÅ»¯ ¾ÍÊÇÐøËã Õâ¸öÊÇwindowsϵÄŶ £¨ÎÒÊÔ¹ý   £©

µ«ÊÇÎÒÒ²ÕâÑùÊÔ¹ýºÃÏñûʡʲôʱ¼ä£¬¶ÏµãºóºÍԭʼ½ø³Ì»¹ÊÇÓÐÇø±ðµÄ
10Â¥2010-11-29 11:05:28
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ ocean08 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] ²ÄÁÏÀà284µ÷¼Á +42 Ïë»»ÊÖ»ú²»Ïë½âÊ 2026-04-08 50/2500 2026-04-15 06:09 by åÐÒ£ÈýÀÉ
[¿¼ÑÐ] 085400µç×ÓÐÅÏ¢Àࣨ´¨´ó¿ØÖƹ¤³Ì£©Çóµ÷¼Á¿É¿çרҵ ÇóÀÏʦÁªÏµ +6 626776879 2026-04-08 6/300 2026-04-14 20:09 by gwjxiaolang
[¿¼ÑÐ] Çóµ÷¼Á +9 СÄô°®Ñ§Ï° 2026-04-11 13/650 2026-04-14 19:18 by Art1977
[¿¼ÑÐ] 085500Çóµ÷¼Á²ÄÁÏ +11 Ò×11122 2026-04-09 11/550 2026-04-14 17:59 by lhj2009
[¿¼ÑÐ] Ò»Ö¾Ô¸¹þ¹¤´ó 085600 277 12²Ä¿Æ»ùÇóµ÷¼Á 5+5 chenny174 2026-04-10 37/1850 2026-04-14 07:39 by Abskk
[¿¼ÑÐ] »úе¹¤³Ì313·ÖÕÒ¹¤¿Æµ÷¼Á +4 ˫һÁ÷±¾¿Æ»úе 2026-04-08 4/200 2026-04-14 07:32 by Abskk
[¿¼ÑÐ] Ò»Ö¾Ô¸Î÷½»»úеר˶Çóµ÷¼Á +9 ÇóÉϰ¶µÄСÍõ 2026-04-10 9/450 2026-04-13 16:08 by jiangguiquan11
[¿¼ÑÐ] ÉúÎïѧµ÷¼Á +11 СȽҪŬÁ¦ 2026-04-10 13/650 2026-04-13 11:46 by µç»¯Ñ§¼°´ß»¯
[¿¼ÑÐ] ÉúÎïѧµ÷¼Á£¬Ò»Ö¾Ô¸Î÷ÄÏ´óѧ348£¬TopÆÚ¿¯Ò»Çø¶þ×÷¡¢¶þÇøÈý×÷£¬ÈýµÈ½±Ñ§½ðÈý´Î +5 candyyyi 2026-04-09 5/250 2026-04-13 09:02 by ¿Éµ­²»¿ÉÍü
[¿¼ÑÐ] 322Çóµ÷¼Á£¬08¹¤¿Æ +4 ½ñÌìÊǸöСºÅ 2026-04-08 4/200 2026-04-13 00:20 by baobaoye
[¿¼ÑÐ] 322Çóµ÷¼Á +6 123°²¿µ 2026-04-12 13/650 2026-04-12 15:51 by 123°²¿µ
[¿¼ÑÐ] µ÷¼Á +10 Ö»ÐðÀë±ð´Ç 2026-04-09 12/600 2026-04-11 20:57 by ÄæË®³Ë·ç
[¿¼ÑÐ] 270Çóµ÷¼Á +14 ÑîÀÖ369 2026-04-11 14/700 2026-04-11 20:16 by À¶ÔÆË¼Óê
[¿¼ÑÐ] 359Çóµ÷¼Á +5 θ¾·ÂÎÀÛÁË 2026-04-11 5/250 2026-04-11 19:55 by lbsjt
[¿¼ÑÐ] Çóµ÷¼Á +3 θ¾·ÂÎÀÛÁË 2026-04-11 5/250 2026-04-11 14:13 by luhong1990
[¿¼ÑÐ] 297Çóµ÷¼Á +9 Kwgyz 2026-04-09 9/450 2026-04-11 10:09 by zhq0425
[¿¼ÑÐ] µ÷¼Á +19 2261744733 2026-04-08 19/950 2026-04-09 19:11 by vgtyfty
[¿¼ÑÐ] µ÷¼Á +12 ÔÂ@163.com 2026-04-08 12/600 2026-04-09 14:27 by rl1980
[¿¼ÑÐ] 296Çóµ÷¼Á +3 Íô£¡£¿£¡ 2026-04-08 3/150 2026-04-08 22:00 by zhouyuwinner
[¿¼ÑÐ] ¿¼ÑÐÇóµ÷¼Á +4 ö©??? 2026-04-08 4/200 2026-04-08 21:44 by ÍÁľ˶ʿÕÐÉú
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û