| ²é¿´: 1920 | »Ø¸´: 3 | |||
| µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû | |||
aa644387857ͳæ (СÓÐÃûÆø)
|
[½»Á÷]
Castep ÀïÃæ Find SymmetryÔõôÓà ÒÑÓÐ1È˲ÎÓë
|
||
| ÇëÎÊCastep ÀïÃæ Find Symmetry¸ÃʲôʱºòÓ𡣿Çë¸ßÊÖ°ïæ½â¾ö£¬Ð»Ð»ÁË£¡£¡ |
» ²ÂÄãϲ»¶
Ò»Ö¾Ô¸ÖØÇì´óѧ085700×ÊÔ´Óë»·¾³×Ü·Ö308Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
Äϲý´óѧ²ÄÁÏר˶311·ÖÇóµ÷¼Á
ÒѾÓÐ6È˻ظ´
316Çóµ÷¼Á
ÒѾÓÐ6È˻ظ´
346Çóµ÷¼Á[0856]
ÒѾÓÐ7È˻ظ´
һ־Ըɽ´ó07»¯Ñ§ 332·Ö ËÄÁù¼¶Òѹý ±¾¿ÆÉ½¶«Ë«·Ç Çóµ÷¼Á£¡
ÒѾÓÐ3È˻ظ´
310Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
»úеר˶299Çóµ÷¼ÁÖÁ²ÄÁÏ
ÒѾÓÐ4È˻ظ´
070300»¯Ñ§319Çóµ÷¼Á
ÒѾÓÐ7È˻ظ´
08¹¤¿Æ 320×Ü·Ö Çóµ÷¼Á
ÒѾÓÐ6È˻ظ´
Ò»Ö¾Ô¸Ìì½ò´óѧ»¯Ñ§¹¤ÒÕרҵ£¨081702£©315·ÖÇóµ÷¼Á
ÒѾÓÐ12È˻ظ´
» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:
CASTEPÀïÃæÔªËØ¼Û̬ÉèÖõÄÎÊÌâ¡£ ÓÐµãÆæ¹Ö£¬Íû¸÷λͬÐÐÒ»ÆðÌÖÂÛÏÂ
ÒѾÓÐ0È˻ظ´
ÔÚ.castepÎļþÀïÃæÄÄÀï¿ÉÒÔ¿´µ½²ÎÓë¼ÆËãµÄÔ×Ó¸öÊý£¿
ÒѾÓÐ3È˻ظ´
castepÀïÃæµÄ¸÷¸ö²ÎÊý¶Ô½ðÊô¾§ÌåÄÜÁ¿µÄÓ°Ï죡ÔÀí£¡
ÒѾÓÐ0È˻ظ´
ÎÄÏ×ÀïÃævaspµÄUÖµ£¬castep¿ÉÒÔʹÓò»
ÒѾÓÐ2È˻ظ´
ÈçºÎ´ÓBandStr. Castep ÎļþÀïÃæ¼ÆËã³ö´øÏ¶£¿ Ê®·Ö¸Ðл£¡£¡
ÒѾÓÐ6È˻ظ´
ms½á¹û³öÎÊÌâÁË£¬ÓÖ³öÏÖ´íÎó£¬castepÀïÃæÓиöwarning£¬ÈçÏÂ
ÒѾÓÐ7È˻ظ´
Çë½ÌһϹØÓÚÉèÖÃcastepÀïÃæµÄGGA+UµÄÎÊÌâ
ÒѾÓÐ6È˻ظ´
castepÀïÃæÈçºÎʹÓÃÔÓ»¯·ºº¯ HSE
ÒѾÓÐ4È˻ظ´
castep¼ÆËãÇóÖú
ÒѾÓÐ5È˻ظ´
¹ØÓÚCASTEP
ÒѾÓÐ3È˻ظ´
¹ØÓÚCASTEPÀïÃæµÄÒ»¸öÑ¡Ïî²»Ã÷°×
ÒѾÓÐ7È˻ظ´
CASTEP¼ÓѹÎÊÌâ
ÒѾÓÐ10È˻ظ´
castep¼ÆËãµÄ¾§Ìå½á¹¹£¬bandsÎÞ´øÏ¶¶ødosÀïÃæÓУ¬ÈçºÎÈ϶¨²ÄÁÏ£¿castepÓöµ½µ¼Ìå?
ÒѾÓÐ9È˻ظ´
¼ÆËã³öµÄ²¼¾ÓÊý¸ÃÔõô·ÖÎöÄØ£¿castepÀïÃæµç¸ºÐÔÊÇÊÇÔõô¸ø³öµÄѽ£¿
ÒѾÓÐ6È˻ظ´
³¬ÍêÕûµÄMS¼°CASTEP×ÊÁÏÏÂÔØ
ÒѾÓÐ561È˻ظ´
MSÀïÃæCASTEP¼ÆËãÄÜ´øLDA+U¼ÆËãUÖµµÄÈ·¶¨
ÒѾÓÐ14È˻ظ´
¡¾ÇóÖú¡¿ÇëÎÊÈçºÎ¿´vasp½á¹¹ÓÅ»¯µÄ¹ý³Ì£¬¾ÍÏñcastepÀïÃæµÄ¹ì¼£Ò»Ñù¡£
ÒѾÓÐ7È˻ظ´
¡¾ÇóÖú¡¿ÇëÎÊÔõô½¨Ä£ÔÚcastepÀïÃæ£¿
ÒѾÓÐ7È˻ظ´
¡¾ÇóÖú¡¿CastepÀïÃæ¼ÆËãÉù×ÓɫɢÇúÏß
ÒѾÓÐ2È˻ظ´
¡¾ÇóÖú¡¿ÔÚcastepÀïÃæÈçºÎ¿¼ÂÇ´ÅÐÔ
ÒѾÓÐ6È˻ظ´
¡¾ÇóÖú¡¿Çë½ÌÈçºÎÔÚMS£¬castepÄ£¿éÀïÃæÊµÏÖ¼ÓѹǿÕâÒ»¹¦ÄÜ£¿
ÒѾÓÐ19È˻ظ´
¡¾ÇóÖú¡¿ÔÚcastepÀïÃæ£¬ÄÜ·ñ²â³ö·Ç³É¼üÁ½Ô×ÓµÄbondorderÄØ
ÒѾÓÐ1È˻ظ´
¡¾ÇóÖú¡¿castepÀïÃæÎ¶ÈÉèÖÃ
ÒѾÓÐ16È˻ظ´

aa644387857
ͳæ (СÓÐÃûÆø)
- Ó¦Öú: 1 (Ó×¶ùÔ°)
- ½ð±Ò: 171.1
- É¢½ð: 170
- ºì»¨: 3
- Ìû×Ó: 204
- ÔÚÏß: 117.2Сʱ
- ³æºÅ: 1347536
- ×¢²á: 2011-07-16
- ÐÔ±ð: GG
- רҵ: »¯Ñ§¹¤³Ì¼°¹¤Òµ»¯Ñ§
|
Äã˵µÄÓ¦¸ÃÊÇshow symmetry°É¡£ÎÒ¿´helpÀï¼ÆËãCOÔÚPb±íÃæÎü¸½Ê±£¬ÔÚ¼ÆËã֮ǰ˵COµÄÎü¸½¸Ä±äÁËPb¾§Ìå½á¹¹£¬ËùÒÔÐèÒªÓÃfind symmetry¡£ÎÒËã¹ýÓûò²»ÓÃfind symmetryµÄÁ½ÖÖÇé¿ö£¬CO¶¼·ÅÔÚPb±íÃæ¶Ô³ÆÖÐÐÄ£¬ÔÚ²»ÓÃÇé¿öϹ¹ÐÍΪP1£¬½á¹¹ÅÜÍêÂÒÆß°ËÔ㣬¶øÇÒ¼ÆËãʱ¼äºÜ³¤¡£ÔÚÓõÄÇé¿öÏÂÓÉÓÚCOÕýºÃ·ÅÔÚPb±íÃæ¶Ô³ÆÖÐÐÄ£¬¹¹ÐÍÓÉP1 ¸ÄΪÁËPMM2£¬ÅܵĽϿ죬COÖ»ÉÏϱ䶯¡£µ«Èç¹ûCO²»ÔÚ±íÃæ¶Ô³ÆÖÐÐĵϝ£¬ÓÉÓÚ¾§°û²»ÊÇPMM2£¬Ò²»áÅܵÃÂÒÆß°ËÔã¡£ËùÒÔÎÒ²»Ã÷°×µ½µ×¸ÄʲôʱºòÓ𡣡Âé·³Äã½øÒ»²½Ö¸µ¼Ö¸µ¼£¬ºÇºÇ£¡ |

4Â¥2011-08-25 17:33:34
luobenhua
ľ³æ (ÕýʽдÊÖ)
ؤ°ïÊ×ϯר¼Ò
- Ó¦Öú: 2 (Ó×¶ùÔ°)
- ½ð±Ò: 2065.5
- É¢½ð: 28
- ºì»¨: 1
- Ìû×Ó: 450
- ÔÚÏß: 241.1Сʱ
- ³æºÅ: 868437
- ×¢²á: 2009-10-11
- ÐÔ±ð: GG
- רҵ: ÎÛȾ¿ØÖÆ»¯Ñ§
¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
youzhizhe(½ð±Ò+1): лл½»Á÷¡£ 2011-08-24 15:55:34
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû
youzhizhe(½ð±Ò+1): лл½»Á÷¡£ 2011-08-24 15:55:34
| ѰÕÒ¶Ô³ÆÐԵİ¡¡£±ÈÈçÓÐЩʱºòÓÅ»¯Í꣬¾§Ìå½á¹¹»á·¢Éú±ä»¯£¬µ«ÊÇÄãÓÖÐèÒªÕÒµ½¾§°ûÀàÐÍ¡£ |
2Â¥2011-08-24 14:56:18
luobenhua
ľ³æ (ÕýʽдÊÖ)
ؤ°ïÊ×ϯר¼Ò
- Ó¦Öú: 2 (Ó×¶ùÔ°)
- ½ð±Ò: 2065.5
- É¢½ð: 28
- ºì»¨: 1
- Ìû×Ó: 450
- ÔÚÏß: 241.1Сʱ
- ³æºÅ: 868437
- ×¢²á: 2009-10-11
- ÐÔ±ð: GG
- רҵ: ÎÛȾ¿ØÖÆ»¯Ñ§
¡ï
youzhizhe(½ð±Ò+1): лл½»Á÷¡£ 2011-08-24 15:55:46
youzhizhe(½ð±Ò+1): лл½»Á÷¡£ 2011-08-24 15:55:46
| ¶à¿´¿´Èí¼þÖеÄhelp£¬ºÇºÇ¡£ |
3Â¥2011-08-24 14:56:42













»Ø¸´´ËÂ¥