±±¾©Ê¯ÓÍ»¯¹¤Ñ§Ôº2026ÄêÑо¿ÉúÕÐÉú½ÓÊÕµ÷¼Á¹«¸æ
²é¿´: 1397  |  »Ø¸´: 7

C_X_L

½ð³æ (СÓÐÃûÆø)

Ñ©

[ÇóÖú] ÌåϵUVÆ×µÄ¶Ô³ÆÐÔÎÊÌâÇó½âÊÍ ÒÑÓÐ1È˲ÎÓë

ÔÚ¼ÆËãÌåϵUVÆ×ʱ£¬ÔÚÊä³öÎļþÖгöÏÖµÄSGGºÍSGUÕâÀà×ÖĸÊÇ´ú±í¹ìµÀµÄ¶Ô³ÆÐÔÂ𣿴Óʲô×ÊÁÏÄܹ»Á˽âÕâÀà×Öĸ×éºÏµÄ¾ßÌ庬Ò壿  ¶Ô³ÆÐÔSinglet-?SymÖÐΪʲô»áÓÐÎʺţ¬£¿SymÊÇʲôÒâ˼£¬Çó½â´ð
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

ÇóÖªÇó½â
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ǹÏÂÓλê

ľ³æ (ÖøÃûдÊÖ)

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
gmy1990: ½ð±Ò+1 2014-07-03 21:03:55
C_X_L: ½ð±Ò+10, ¡ï¡ï¡ïºÜÓаïÖú 2014-07-09 21:50:17
SGGºÍSGU³öÏÖÔÚÄÄÀ
£¿symÕâ¿éµØ·½Ó¦¸ÃÏÔʾµÄÊǿռä¶Ô³ÆÐÔ£¬£¿sym±íʾµÄÒâ˼ÎÒÈÏΪÊÇϵͳÎÞ·¨ÅжϴË̬µÄ¶Ô³ÆÐÔ¡£
2Â¥2014-07-03 13:43:31
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

C_X_L

½ð³æ (СÓÐÃûÆø)

Ñ©

ÒýÓûØÌû:
2Â¥: Originally posted by ǹÏÂÓλê at 2014-07-03 13:43:31
SGGºÍSGU³öÏÖÔÚÄÄÀ
£¿symÕâ¿éµØ·½Ó¦¸ÃÏÔʾµÄÊǿռä¶Ô³ÆÐÔ£¬£¿sym±íʾµÄÒâ˼ÎÒÈÏΪÊÇϵͳÎÞ·¨ÅжϴË̬µÄ¶Ô³ÆÐÔ¡£

Orbital symmetries:
       Occupied  (SGG) (SGU) (SGG) (PIU)
       Virtual   (PIU) (PIG) (PIG) (SGU) (SGG) (PIU) (PIU) (SGU)
                 (PIG) (PIG) (SGG) (SGU)
ÎÒÏëÖªµÀSGG¡¢SGU¾ßÌå´ú±íʲôÒÔ¼°ËûÃÇÖ®¼äµÄ¹ØÏµ
ÇóÖªÇó½â
3Â¥2014-07-03 14:05:53
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ǹÏÂÓλê

ľ³æ (ÖøÃûдÊÖ)

¡ï
gmy1990: ½ð±Ò+1 2014-07-03 21:04:06
ÒýÓûØÌû:
3Â¥: Originally posted by C_X_L at 2014-07-03 14:05:53
Orbital symmetries:
       Occupied  (SGG) (SGU) (SGG) (PIU)
       Virtual   (PIU) (PIG) (PIG) (SGU) (SGG) (PIU) (PIU) (SGU)
                 (PIG) (PIG) (SGG) (SGU)
ÎÒÏëÖªµÀSGG¡¢SGU¾ßÌå´ú±íʲô ...

ÎÒµÄÀí½âÊÇÕâÑù£º
ÎÒ½²Á½¸ö£¬ÄãÓ¦¸Ã¾Í¶®ÁË
SG-G£º sigma-gerade
PI-U£º pi-ungarede
4Â¥2014-07-03 14:18:38
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

C_X_L

½ð³æ (СÓÐÃûÆø)

Ñ©

ÒýÓûØÌû:
4Â¥: Originally posted by ǹÏÂÓλê at 2014-07-03 14:18:38
ÎÒµÄÀí½âÊÇÕâÑù£º
ÎÒ½²Á½¸ö£¬ÄãÓ¦¸Ã¾Í¶®ÁË
SG-G£º sigma-gerade
PI-U£º pi-ungarede...

sigma-gerade±íʾsigma¶Ô³Æ£¬PI¡ªU±íʾPI·Ç¶Ô³Æ£¿Õâ¸öÌý˵¹ý£¬µ«²»ÊǺÜÃ÷°×¡£ÇëÎÊÄúÄÜ·ñ¸øÎÒÍÆ¼ö¸öÍøÕ¾»ò×ÊÁÏ£¬ÈÃÎÒ¾ßÌåѧϰһÏÂ...
ÇóÖªÇó½â
5Â¥2014-07-05 12:46:43
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ǹÏÂÓλê

ľ³æ (ÖøÃûдÊÖ)

ÒýÓûØÌû:
5Â¥: Originally posted by C_X_L at 2014-07-05 12:46:43
sigma-gerade±íʾsigma¶Ô³Æ£¬PI¡ªU±íʾPI·Ç¶Ô³Æ£¿Õâ¸öÌý˵¹ý£¬µ«²»ÊǺÜÃ÷°×¡£ÇëÎÊÄúÄÜ·ñ¸øÎÒÍÆ¼ö¸öÍøÕ¾»ò×ÊÁÏ£¬ÈÃÎÒ¾ßÌåѧϰһÏÂ......

ungaredeÓ¦¸ÃÊÇ·´¶Ô³Æ
6Â¥2014-07-06 09:16:47
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

C_X_L

½ð³æ (СÓÐÃûÆø)

Ñ©

ÒýÓûØÌû:
6Â¥: Originally posted by ǹÏÂÓλê at 2014-07-06 09:16:47
ungaredeÓ¦¸ÃÊÇ·´¶Ô³Æ...

ÎÒ¿´¹ýÕâôһ¾ä»°£¬¹ìµÀ1ÊÇB3U£¬¹ìµÀ11ÊÇB2U£¬µç×Ó´Ó¹ìµÀ1ԾǨµ½¹ìµÀ11ñîºÏºóΪB1U£¬ÇëÎÊÕâÊÇÈçºÎµÃµ½µÄ£¬ÊDz»ÊÇñîºÏÓÐʲô¹«Ê½Ö®ÀàµÄ£¿ÎÒÏëÁ˽âһϹìµÀÉϵç×Ó¸÷ÖֶԳƵÄÃ÷È·Òâ˼£¬ÒÔ¼°ÔõôÄÜÅжÏñîºÏÖ®ºóµÄ¶Ô³ÆÀàÐÍ£¿
ÇóÖªÇó½â
7Â¥2014-07-06 22:27:18
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ǹÏÂÓλê

ľ³æ (ÖøÃûдÊÖ)

ÒýÓûØÌû:
7Â¥: Originally posted by C_X_L at 2014-07-06 22:27:18
ÎÒ¿´¹ýÕâôһ¾ä»°£¬¹ìµÀ1ÊÇB3U£¬¹ìµÀ11ÊÇB2U£¬µç×Ó´Ó¹ìµÀ1ԾǨµ½¹ìµÀ11ñîºÏºóΪB1U£¬ÇëÎÊÕâÊÇÈçºÎµÃµ½µÄ£¬ÊDz»ÊÇñîºÏÓÐʲô¹«Ê½Ö®ÀàµÄ£¿ÎÒÏëÁ˽âһϹìµÀÉϵç×Ó¸÷ÖֶԳƵÄÃ÷È·Òâ˼£¬ÒÔ¼°ÔõôÄÜÅжÏñîºÏÖ®ºóµÄ¶Ô³ÆÀà ...

ÄÇ¿ÉÄܼ¤·¢Ì¬Ï´˹ìµÀµÄ¶Ô³ÆÐÔÓÐËù¸Ä±ä£¬¼´½á¹¹Óб仯ÁË¡£Õâ¸öÎÒÒ²²»¶®£¬ÄãÐèҪȥ¿´Ò»ÏÂȺÂÛµÄÏà¹ØÖªÊ¶
8Â¥2014-07-07 09:24:48
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ C_X_L µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] ²ÄÁÏÓ뻯¹¤085600£¬×Ü·Ö304£¬±¾¿ÆÓÐÁ½Æªsci²ÎÓ룬Çóµ÷¼Á +8 ÐÒÔ˵Ľ´½´ 2026-03-22 10/500 2026-03-27 11:38 by ÐÒÔ˵Ľ´½´
[¿¼ÑÐ] Äϲý´óѧ²ÄÁÏר˶311·ÖÇóµ÷¼Á +10 77chaselx 2026-03-20 10/500 2026-03-27 11:28 by wangjy2002
[¿¼ÑÐ] 315µ÷¼Á +4 0860Çóµ÷¼Á 2026-03-26 5/250 2026-03-27 11:23 by wangjy2002
[¿¼ÑÐ] µ÷¼ÁÍÆ¼ö +5 Ç徯714 2026-03-26 6/300 2026-03-27 11:12 by ²»³Ôô~µÄ؈
[ÂÛÎÄͶ¸å] Journal of Mechanical Science and Technology +3 Russ_ss 2026-03-25 5/250 2026-03-27 10:49 by ½С¹û»­´ó±ý
[¿¼ÑÐ] 324Çóµ÷¼Á +5 hanamiko 2026-03-26 5/250 2026-03-27 10:33 by wangjy2002
[¿¼ÑÐ] ²ÄÁÏѧ˶333Çóµ÷¼Á +8 ±±µÀÏï 2026-03-24 8/400 2026-03-27 10:18 by ÎÒÊÇС¿µ
[˶²©¼ÒÔ°] ÕÐÊÕÉúÎïѧ/ϸ°ûÉúÎïѧµ÷¼Á +3 IceGuo 2026-03-26 4/200 2026-03-27 05:35 by user003
[¿¼ÑÐ] 329Çóµ÷¼Á +7 Å¥¶÷Ñ© 2026-03-25 7/350 2026-03-27 04:28 by wxiongid
[¿¼ÑÐ] Ò»Ö¾Ô¸Ö£ÖÝ´óѧ£¬080500ѧ˶£¬×Ü·Ö317·ÖÇóµ÷¼Á +4 ¾Ù¸öÀõ×Óoi 2026-03-24 5/250 2026-03-26 23:15 by ²»³Ôô~µÄ؈
[¿¼ÑÐ] Çóµ÷¼Á +5 «lty 2026-03-25 6/300 2026-03-26 20:49 by ²»³Ôô~µÄ؈
[¿¼ÑÐ] ²ÄÁϵ÷¼Á 5+4 ÏëÒªÒ»ºøÌÒ»¨Ë® 2026-03-25 10/500 2026-03-26 19:56 by ²»³Ôô~µÄ؈
[¿¼ÑÐ] Öйú¿ÆÑ§ÔºÉîÛÚÏȽø¼¼ÊõÑо¿Ôº-¹âÏË´«¸Ð¿ÎÌâ×éÕÐÉú-Öйú¿ÆÑ§Ôº´óѧ¡¢ÉîÛÚÀí¹¤´óѧÁªÅà +5 YangTyu1 2026-03-26 5/250 2026-03-26 18:27 by èßäèßäѽ
[¿¼ÑÐ] 085601Çóµ÷¼Á×Ü·Ö293Ó¢Ò»Êý¶þ +4 ¸ÖÌú´óÅÚ 2026-03-24 4/200 2026-03-26 16:28 by dick_runner
[¿¼ÑÐ] 0856µ÷¼Á +4 ÇóÇóÈÃÎÒÓÐÊé¶Á° 2026-03-26 5/250 2026-03-26 15:54 by dick_runner
[¿¼ÑÐ] 289²ÄÁÏÓ뻯¹¤£¨085600£©BÇøÇóµ÷¼Á +4 ÕâôÃû×ÖÕ¦Ñù 2026-03-22 5/250 2026-03-25 08:20 by mx.yue
[¿¼ÑÐ] 291Çóµ÷¼Á +3 HanBeiNingZC 2026-03-24 3/150 2026-03-24 16:34 by barlinike
[¿¼ÑÐ] 300Çóµ÷¼Á£¬²ÄÁÏ¿ÆÑ§Ó¢Ò»Êý¶þ +5 leaflight 2026-03-24 5/250 2026-03-24 16:25 by laoshidan
[¿¼ÑÐ] 284Çóµ÷¼Á +3 yanzhixue111 2026-03-23 6/300 2026-03-23 22:58 by pswait
[¿¼ÑÐ] ²ÄÁÏ/ũҵרҵ£¬07/08¿ªÍ·¾ù¿É£¬¹ýÏß¾ÍÐÐ +3 ºÇßíŶ»í 2026-03-23 4/200 2026-03-23 22:30 by Íô£¡£¿£¡
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û