±±¾©Ê¯ÓÍ»¯¹¤Ñ§Ôº2026ÄêÑо¿ÉúÕÐÉú½ÓÊÕµ÷¼Á¹«¸æ
²é¿´: 1123  |  »Ø¸´: 5
¡¾ÐüÉͽð±Ò¡¿»Ø´ð±¾ÌûÎÊÌ⣬×÷Õßwudiya½«ÔùËÍÄú 15 ¸ö½ð±Ò
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

wudiya

гæ (³õÈëÎÄ̳)

[ÇóÖú] ¼ÆËãÁ½½ðÊô½çÃæÖ®¼äµÄµç×èÇóÖú

´ó¼ÒºÃ£¬ÏëÏò¸÷λÇë½Ìһϡ£ÎÒÏÖÔÚÔÚµ÷ÑÐÈçºÎ¼ÆËãÁ½¸ö½ðÊô½çÃæÖ®¼äµÄµç×裬Ŀǰ²éÔĵÄÎÄÏ×·¢Ïֺܶ඼ÊÇʹÓõÄh/eµÄƽ·½³ËÒÔ(1/µç×ÓÔÚ½çÃæµÄ´«Êä¸ÅÂÊÖ®ºÍ¼õÈ¥Á½¸öɳÎĵç×è)Õâ¸ö¹«Ê½,ÒòΪ±¾ÈËÊÇ´¿Ð¡°×£¬ËùÒÔÏ£Íû¸÷λ´óÀпÉÒÔ½âÊÍÒ»ÏÂÔõôÓõÚÒ»ÐÔÔ­Àí¼ÆËãÕâ¸ö¹«Ê½µÄ²ÎÊý(µç×ÓÔÚ½çÃæµÄ´«Êä¸ÅÂÊÖ®ºÍ£¬É³Îĵç×è)£¬ÒÔ¼°ÓÃʲôÈí¼þ¿ÉÒÔʵÏÖÇó½â¡£
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

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

wudiya

гæ (³õÈëÎÄ̳)

ÒýÓûØÌû:
2Â¥: Originally posted by fyuewen at 2023-11-11 10:26:51
ÄãÕâ¸öÊôÓÚelectron transportÎÊÌ⣬µÃÓÃNEGF-DFT·½·¨¡£

ÄÇÇëÎÊÕâÖÖ·½·¨¿ÉÒÔͨ¹ýVASPʵÏÖ£¬ÒòΪÎÒ²»ÊÇÑо¿µÚÒ»ÐÔÔ­ÀíµÄ£¬Ö»ÊǸºÔðµ÷Ñв»ÊǺܶ®
4Â¥2023-11-11 18:24:37
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 6 ¸ö»Ø´ð

fyuewen

½ð³æ (ÕýʽдÊÖ)

ÄãÕâ¸öÊôÓÚelectron transportÎÊÌ⣬µÃÓÃNEGF-DFT·½·¨¡£
Physicsloveukulele!Aloha!
2Â¥2023-11-11 10:26:51
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

wudiya

гæ (³õÈëÎÄ̳)

ÒýÓûØÌû:
2Â¥: Originally posted by fyuewen at 2023-11-11 10:26:51
ÄãÕâ¸öÊôÓÚelectron transportÎÊÌ⣬µÃÓÃNEGF-DFT·½·¨¡£

ºÃµÄºÃµÄ£¬·Ç³£¸Ðл
3Â¥2023-11-11 18:22:59
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

fyuewen

½ð³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
4Â¥: Originally posted by wudiya at 2023-11-11 18:24:37
ÄÇÇëÎÊÕâÖÖ·½·¨¿ÉÒÔͨ¹ýVASPʵÏÖ£¬ÒòΪÎÒ²»ÊÇÑо¿µÚÒ»ÐÔÔ­ÀíµÄ£¬Ö»ÊǸºÔðµ÷Ñв»ÊǺܶ®...

VASP²»¿ÉÒÔ¡£ÄãgoogleһϾÍÄÜÖªµÀʲôcode¿ÉÒÔËã¡£

» ±¾ÌûÒÑ»ñµÃµÄºì»¨£¨×îÐÂ10¶ä£©

Physicsloveukulele!Aloha!
5Â¥2023-11-14 22:18:01
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²»Ó¦Öú È·¶¨»ØÌûÓ¦Öú (×¢Ò⣺ӦÖú²Å¿ÉÄܱ»½±Àø£¬µ«²»ÔÊÐí¹àË®£¬±ØÐëÌîд15¸ö×Ö·ûÒÔÉÏ)
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 085600 ²ÄÁÏÓ뻯¹¤ 329·ÖÇóµ÷¼Á +13 Mr. Z 2026-03-25 13/650 2026-03-29 15:24 by ÌÆãå¶ù
[¿¼ÑÐ] 327Çóµ÷¼Á +6 ¼³Òàê» 2026-03-29 6/300 2026-03-29 13:40 by peike
[¿¼ÑÐ] 318Ò»Ö¾Ô¸¼ªÁÖ´óѧÉúÎïÓëÒ½Ò© Çóµ÷¼Á +4 óÆÐÐÖÂÔ¶. 2026-03-28 4/200 2026-03-29 11:55 by longlotian
[¿¼ÑÐ] ѧ˶274Çóµ÷¼Á +9 LiÀîÓã 2026-03-26 9/450 2026-03-28 21:42 by bymhappy
[¿¼ÑÐ] ʳƷ¹¤³Ìר˶һ־ԸÖк£Ñó309Çóµ÷¼Á +4 СÕÅzxyÕÅ 2026-03-26 8/400 2026-03-28 19:25 by lbsjt
[¿¼ÑÐ] 312£¬ÉúÎïѧÇóµ÷¼Á +3 СÒëͬѧabc 2026-03-28 3/150 2026-03-28 15:32 by ÂäÉ˼
[¿¼ÑÐ] 299Çóµ÷¼Á +7 àÅàÅàÅàÅ2 2026-03-27 7/350 2026-03-28 13:09 by ÌÆãå¶ù
[¿¼ÑÐ] 081200-314 +3 LILIQQ 2026-03-27 4/200 2026-03-28 09:41 by ±£»¤µØÇòÄãÎÒ×öÆ
[¿¼ÑÐ] 315·ÖÇóµ÷¼Á +7 26¿¼ÑÐÉϰ¶°æ26 2026-03-26 7/350 2026-03-28 04:05 by fmesaito
[¿¼ÑÐ] 287Çóµ÷¼Á +10 land xuxu 2026-03-26 10/500 2026-03-27 15:33 by ÅÁ¶ûÂíÀ­ÌØ
[¿¼ÑÐ] 348Çóµ÷¼Á +4 СÀÁ³æ²»ÀÁÁË 2026-03-27 5/250 2026-03-27 12:47 by ¹û¹ûÂèßä
[¿¼ÑÐ] Ò»Ö¾Ô¸»ª¶«Àí¹¤´óѧ081700£¬³õÊÔ·ÖÊý271 +6 kotoko_ik 2026-03-23 7/350 2026-03-27 12:29 by »ÝÖÝÅíÓÚêÌ
[¿¼ÑÐ] 327Çóµ÷¼Á +7 prayer13 2026-03-23 7/350 2026-03-26 20:48 by ²»³Ôô~µÄ؈
[¿¼ÑÐ] ²ÄÁÏ¿¼ÑÐÇóµ÷¼Á +3 Dendel 2026-03-23 6/300 2026-03-26 17:51 by fmesaito
[¿¼ÑÐ] 303Çóµ÷¼Á +6 À¶É½Ô 2026-03-25 6/300 2026-03-25 22:47 by 418490947
[¿¼ÑÐ] ¡¾2026¿¼Ñе÷¼Á¡¿ÖÆÒ©¹¤³Ì 284·Ö ÇóÏà¹Ø×¨Òµµ÷¼ÁÃû¶î +4 Ô¬Û¼Û¼ 2026-03-25 8/400 2026-03-25 14:32 by lbsjt
[¿¼ÑÐ] 340Çóµ÷¼Á +5 »°Ã·ÌÇ111 2026-03-24 5/250 2026-03-25 06:53 by ilovexiaobin
[¿¼ÑÐ] Ò»Ö¾Ô¸ºÓ±±¹¤Òµ´óѧ0817»¯¹¤278·ÖÇóµ÷¼Á +7 jhybd 2026-03-23 12/600 2026-03-24 09:03 by jhybd
[¿¼ÑÐ] 335Çóµ÷¼Á +4 yuyuÓî 2026-03-23 5/250 2026-03-23 23:49 by Txy@872106
[¿¼ÑÐ] ½ÓÊÕ2026˶ʿµ÷¼Á(ѧ˶+ר˶) +4 allen-yin 2026-03-23 6/300 2026-03-23 15:04 by Íô£¡£¿£¡
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û