²é¿´: 1880  |  »Ø¸´: 7

qawzes

Ìú³æ (СÓÐÃûÆø)

[ÇóÖú] ·èÁË£¬Õâ¾ä»°ÎÒ¿´²»¶® ÒÑÓÐ2È˲ÎÓë

The integration of the Brillouin  zone  is  done  at  the  ¦£-point  only  for  amorphous models, whereas appropriate k-point meshes are used for reference calculations of crystal structures.

Ë­ÄܰïÎÒһϣ¬×îºÃÓñȽϹ淶µÄÓïÑÔ£¨·­Òëһϣ©£¬ÎÒÊÇÐÂÊÖ£¬ËµÐл°ÎÒ²»¶®¡£¡£¡£
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

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

dengc09

½û³æ (ÕýʽдÊÖ)

¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
±¾ÌûÄÚÈݱ»ÆÁ±Î

2Â¥2014-06-04 13:33:53
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

qawzes

Ìú³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
2Â¥: Originally posted by dengc09 at 2014-06-04 13:33:53
ÔÚgammaµãµÄ²¼ÀïÔ¨Çø»ý·ÖÖ»ÊÊÓÃÓڷǾ§£¬¾§Ì弯ËãҪѡÔñºÏÊʵÄKµãÍø¸ñ£¬´ó¸Å¾ÍÊÇÄãµÄKµãûÉèÖúÃ

ÄúÄÜ·­ÒëÒ»ÏÂÂ¾ÍÕâ¾ä»°£¬
3Â¥2014-06-04 13:44:21
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

dengc09

½û³æ (ÕýʽдÊÖ)

±¾ÌûÄÚÈݱ»ÆÁ±Î

4Â¥2014-06-04 13:51:45
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

qawzes

Ìú³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
4Â¥: Originally posted by dengc09 at 2014-06-04 13:51:45
ÄãÓõÄÊÇVASP»¹ÊÇʲô£¿ÌåϵÊÇʲôÑùµÄ£¿ÔõôÉèµÄKµã£¿Äܲ»ÄÜÏêϸһµã£¿Äã±ðֻȡgammaµã°¡¡£Ò»°ãa*k1~b*k2~c*k3£¬²»»á´òÔ¼µÈÓÚ£¬·´Õý¾ÍÊÇÒªÓë±ß³¤³É·´±È£¬È»ºó³Ë»ýÒª±È½Ï´ó£¬Ò²¾ÍÊÇ˵´óµÄÌåϵkµã¿ÉÒÔÈ¡µÃÉÙ£¬Ð¡µÄÌå ...

ллÄú°¡£¬Ò»¿´¾ÍÊÇÐмң¬µ«ÊÇ£¬£¬£¬ÆäʵÎÒ¾ÍÊÇ·­ÒëÎÄÏ×£¬ÎÒ²»ÊÇѧÀíÂÛ¼ÆËãµÄ£¬¹ÌÌåÎïÀíÒ²²»Ì«¶®£¬¿ÉÊÇÒªÎÒ·­ÒëµÄÎÄÏ×ÀïÓÐÕâ¾ä»°¡£¡£¡£ÎÒ²»¶®£¬·­Òë²»³É¾ä×Ó£¬£¬£¬ÄúÃ÷°×Á˰ɣ¬Äú°ïÎÒÑϽ÷µÄ·­ÒëһϾͰïÎÒ´óæÁË
5Â¥2014-06-04 13:56:11
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

dengc09

½û³æ (ÕýʽдÊÖ)

±¾ÌûÄÚÈݱ»ÆÁ±Î

6Â¥2014-06-04 14:01:52
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

qawzes

Ìú³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
6Â¥: Originally posted by dengc09 at 2014-06-04 14:01:52
¡£¡£¡£×Ô¼º×éÖ¯ÓïÑÔ°É£¬ÎÒÒ²²»ÊÇÐмң¬¶à°áÁ˼¸Ììש¶øÒÑ¡£¡£¡£ÆäʵÎÊÌâ²»´ó£¬°ÑÎÒÄǾ仰ÔõôÈóɫһϾͺÃ...

for reference calculations of crystal structures. Õâ¸öÎÒ²»Ã÷°×£¬ÄþÄܸøËµÒ»ÏÂÂï
7Â¥2014-06-04 15:32:58
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

clown9111014

Òø³æ (СÓÐÃûÆø)

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
²¼ÀïÔ¨Çøgammaµã»ý·ÖµÄÖ»¶ÔÓڷǾ§Ä£ÐͽøÐÐÁ˼ÆË㣬Ȼ¶øÑ¡È¡Êʵ±µÄkµãÍø¸ñ¶Ô¾§ÌåÄ£Ð͵ļÆËã±»×÷Ϊ²Î¿¼¡£  Ó¦¸ÃÊÇÕâ¸öÒâ˼¡£¡£
ŬÁ¦Ñ§Ï° ±ØÓÐËù»ñ
8Â¥2014-06-04 20:42:07
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ qawzes µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 288Çóµ÷¼Á +4 ÓÚº£º£º£º£ 2026-03-19 4/200 2026-03-19 11:11 by kakakapanpan
[¿¼ÑÐ] Ò»Ö¾Ô¸Ìì´ó²ÄÁÏÓ뻯¹¤£¨085600£©×Ü·Ö338 +5 ²Ì´óÃÀÅ® 2026-03-13 5/250 2026-03-19 10:44 by ÊÇСÁõѽ¡«
[¿¼ÑÐ] Ò»Ö¾Ô¸ÎäÀí²ÄÁÏ305·ÖÇóµ÷¼Á +5 ÏëÉϰ¶µÄÀðÓã 2026-03-18 6/300 2026-03-18 17:53 by Î޼ʵIJÝÔ­
[¿¼ÑÐ] 08¹¤¿Æ 320×Ü·Ö Çóµ÷¼Á +5 À滨çóÍí·ç 2026-03-17 5/250 2026-03-18 14:49 by haxia
[¿¼ÑÐ] 0854£¬¼ÆËã»úÀàÕÐÊÕµ÷¼Á +3 ºúÀ±ÌÀ·ÅÌÇ 2026-03-15 6/300 2026-03-18 12:09 by Éϰ¶Éϰ¶¡­¡­..
[¿¼ÑÐ] ²ÄÁÏ£¬·ÄÖ¯£¬ÉúÎ0856¡¢0710£©£¬»¯Ñ§ÕÐÉúÀ² +3 Eember. 2026-03-17 9/450 2026-03-18 10:28 by Eember.
[¿¼ÑÐ] 265Çóµ÷¼Á +3 ÁºÁºÐ£Ð£ 2026-03-17 3/150 2026-03-18 09:12 by zhukairuo
[¿¼ÑÐ] ¿¼ÑÐÇóµ÷¼Á +3 éÙËÌ. 2026-03-17 4/200 2026-03-17 21:43 by ÓÐÖ»ÀêÅ«
[¿¼ÑÐ] ¿¼Ñл¯Ñ§Ñ§Ë¶µ÷¼Á£¬Ò»Ö¾Ô¸985 +4 ÕÅvvvv 2026-03-15 6/300 2026-03-17 17:15 by ruiyingmiao
[¿¼ÑÐ] 085601Çóµ÷¼Á +4 Du.11 2026-03-16 4/200 2026-03-17 17:08 by ruiyingmiao
[¿¼ÑÐ] 290Çóµ÷¼Á +3 p asserby. 2026-03-15 4/200 2026-03-17 16:35 by wangkm
[¿¼ÑÐ] ²ÄÁÏÓ뻯¹¤×¨Ë¶µ÷¼Á +5 heming3743 2026-03-16 5/250 2026-03-17 14:03 by Ó¸ÒÌ«¼àÍõ¹«¹«
[¿¼ÑÐ] 302Çóµ÷¼Á +4 С¼Öͬѧ123 2026-03-15 8/400 2026-03-17 10:33 by С¼Öͬѧ123
[¿¼ÑÐ] 0703 ÎïÀí»¯Ñ§µ÷¼Á +3 ÎÒ¿ÉÒÔÉϰ¶µÄ¶Ô 2026-03-13 5/250 2026-03-16 10:50 by ÎÒ¿ÉÒÔÉϰ¶µÄ¶ÔÂ
[¿¼ÑÐ] 327Çóµ÷¼Á +6 ʰ¹âÈÎȾ 2026-03-15 11/550 2026-03-15 22:47 by ʰ¹âÈÎȾ
[¿¼ÑÐ] 070305Çóµ÷¼Á +3 mlpqaz03 2026-03-14 4/200 2026-03-15 11:04 by peike
[¿¼ÑÐ] 080500£¬²ÄÁÏѧ˶302·ÖÇóµ÷¼ÁѧУ +4 ³õʶ¿ÉÀÖ 2026-03-14 5/250 2026-03-14 21:08 by peike
[¿¼ÑÐ] ¸´ÊÔµ÷¼Á +3 ºôºô£¿~+123456 2026-03-14 3/150 2026-03-14 16:53 by WTUChen
[¿¼ÑÐ] 295Çóµ÷¼Á +3 Сذ×ÐÖ­ 2026-03-12 3/150 2026-03-13 15:17 by vgtyfty
[¿¼ÑÐ] 290Çóµ÷¼Á +3 ADT 2026-03-13 3/150 2026-03-13 10:19 by peike
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û