²é¿´: 1612  |  »Ø¸´: 3

tian33210

гæ (СÓÐÃûÆø)

[ÇóÖú] ½¨Á¢slabÄ£Ðͺó£¬ÎªÊ²Ã´¼ÓU²¢ÇÒ´ò¿ª×ÔÐý»áºÜÄÑÊÕÁ²£¬¶ø²»¼ÓU²»¿ª×ÔÐý¾ÍÄܹ»ÊÕÁ²¡£ ÒÑÓÐ1È˲ÎÓë

½¨Á¢ÁËÒ»¸ö·Ç¶Ô³ÆµÄslabÄ£ÐÍ£¬¼ÓÁË×ÔÐýºÍUºóµç×Ó²½ÊÕÁ²²»ÁË£¬²»¼ÓUºÍ×ÔÐýµ¹ÊÇÄܹ»ÊÕÁ²ÏëÖªµÀΪʲô¡£
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

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

dt97511

Òø³æ (СÓÐÃûÆø)

°ï¶¥£¬Ë³±ãÇëÎÊÈç¹û¿¼ÂÇ×ÔÐýºÍ¼ÓU£¬ÊDz»ÊÇÔÚINCARÀï¼ÓÈëÒÔÏÂÃüÁî¾ÍÐÐÀ²
ISPIN=2
LDAU = .TRUE.
LDAUTYPE = 2
LDAUL = -1 -1 3
LDAUU = 0.00 0.00 3.50        
LDAUJ =  0.00 0.00 0.50
LDAUPRINT = 2
2Â¥2018-12-18 22:22:24
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

shadowlisong

Ìú¸Ëľ³æ (ÕýʽдÊÖ)

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
·Ç¶Ô³Æ±íÃæ¿¼ÂǼÓÈëdiploe correctionÊÔÒ»ÊÔ

» ±¾ÌûÒÑ»ñµÃµÄºì»¨£¨×îÐÂ10¶ä£©

Hello£¬world
3Â¥2018-12-19 14:50:16
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

tian33210

гæ (СÓÐÃûÆø)

Ëͺ컨һ¶ä
ÒýÓûØÌû:
3Â¥: Originally posted by shadowlisong at 2018-12-19 14:50:16
·Ç¶Ô³Æ±íÃæ¿¼ÂǼÓÈëdiploe correctionÊÔÒ»ÊÔ

ÒѾ­¼ÓÁËż¼«½ÃÕýÁËLDIPOL=.TRUE,IDIPOL=3,»¹ÊÇÓÐÎÊÌâ¡£
4Â¥2018-12-19 17:02:55
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ tian33210 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 294Çóµ÷¼Á²ÄÁÏÓ뻯¹¤×¨Ë¶ +5 ݤÎÉ­ÁÖ 2026-03-18 5/250 2026-03-18 22:18 by bingxueer79
[¿¼ÑÐ] 328Çóµ÷¼Á£¬Ó¢ÓïÁù¼¶551£¬ÓпÆÑо­Àú +3 ÉúÎ﹤³Ìµ÷¼Á 2026-03-17 7/350 2026-03-18 20:41 by Wangjingyue
[¿¼ÑÐ] Ò»Ö¾Ô¸985£¬±¾¿Æ211£¬0817»¯Ñ§¹¤³ÌÓë¼¼Êõ319Çóµ÷¼Á +7 Liwangman 2026-03-15 7/350 2026-03-18 20:08 by walc
[¿¼ÑÐ] 0703»¯Ñ§ 305Çóµ÷¼Á +3 FY_yy 2026-03-14 3/150 2026-03-18 19:40 by macy2011
[¿¼ÑÐ] Ò»Ö¾Ô¸ÎäÀí²ÄÁÏ305·ÖÇóµ÷¼Á +5 ÏëÉϰ¶µÄÀðÓã 2026-03-18 6/300 2026-03-18 17:53 by Î޼ʵIJÝÔ­
[¿¼ÑÐ] 085600²ÄÁÏÓ뻯¹¤ +5 °²È«Éϰ¶£¡ 2026-03-16 5/250 2026-03-18 15:33 by cmz0325
[¿¼ÑÐ] 286Çóµ÷¼Á +6 lemonzzn 2026-03-16 9/450 2026-03-18 15:31 by vgtyfty
[¿¼ÑÐ] 0854¿É¿çµ÷¼Á£¬Ò»×÷Ò»ÏîºËÐÄÂÛÎÄÎåÏîרÀû£¬Ê¡¡¢¹ú¼¶Ö¤Êé40+ÊýÒ»Ó¢Ò»287 +8 СÀî0854 2026-03-16 8/400 2026-03-18 14:35 by ²«»÷518
[¿¼ÑÐ] Ò»Ö¾Ô¸Î÷ÄϽ»´ó£¬Çóµ÷¼Á +4 ²Ä»¯ÖðÃÎÈË 2026-03-18 4/200 2026-03-18 14:22 by 007_lilei
[¿¼ÑÐ] 0703»¯Ñ§µ÷¼Á £¬Áù¼¶Òѹý£¬ÓпÆÑо­Àú +10 êØÎõÙâ 2026-03-15 10/500 2026-03-18 14:19 by 007_lilei
[¿¼ÑÐ] ÉúÎïѧ071000 329·ÖÇóµ÷¼Á +3 ÎÒ°®ÉúÎïÉúÎﰮΠ2026-03-17 3/150 2026-03-18 10:12 by macy2011
[˶²©¼ÒÔ°] ºþ±±¹¤Òµ´óѧ ÉúÃü¿ÆÑ§Ó뽡¿µÑ§Ôº-¿ÎÌâ×éÕÐÊÕ2026¼¶Ê³Æ·/ÉúÎï·½Ïò˶ʿ +3 1ϲ´º8 2026-03-17 5/250 2026-03-17 17:18 by ber´¨cool×Ó
[¿¼ÑÐ] 085600²ÄÁÏÓ뻯¹¤Çóµ÷¼Á +5 Ð÷ÐÒÓë×Ó 2026-03-17 5/250 2026-03-17 16:40 by laoshidan
[¿¼ÑÐ] 274Çóµ÷¼Á +5 ʱ¼äµã 2026-03-13 5/250 2026-03-17 07:34 by ÈÈÇéɳĮ
[¿¼ÑÐ] [µ¼Ê¦ÍƼö]Î÷ÄϿƼ¼´óѧ¹ú·À/²ÄÁϵ¼Ê¦ÍƼö +3 ¼â½ÇСºÉ 2026-03-16 6/300 2026-03-16 23:21 by ¼â½ÇСºÉ
[¿¼ÑÐ] ÇóÀÏʦÊÕÁôµ÷¼Á +4 jiang½ª66 2026-03-14 5/250 2026-03-15 20:11 by Winj1e
[¿¼ÑÐ] ±¾¿ÆÄϾ©´óѧһ־Ը´¨´óҩѧ327 +3 ÂóÌï¸ûÕß 2026-03-14 3/150 2026-03-14 20:04 by ÍâÐÇÎÄÃ÷
[¿¼ÑÐ] ѧ˶285Çóµ÷¼Á +13 Wisjxn 2026-03-12 46/2300 2026-03-14 10:33 by JourneyLucky
[¿¼ÑÐ] £Û0860£Ý321·ÖÇóµ÷¼Á£¬abÇø½Ô¿É +4 ±¦¹óÈÈ 2026-03-13 4/200 2026-03-13 22:01 by ÐÇ¿ÕÐÇÔÂ
[¿¼ÑÐ] 333Çóµ÷¼Á +3 152697 2026-03-12 4/200 2026-03-13 07:08 by Iveryant
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û