Znn3bq.jpeg
²é¿´: 1259  |  »Ø¸´: 2

gaussian08

Òø³æ (СÓÐÃûÆø)

[ÇóÖú] vasp neb ºÍ pwscf nebÓÐʲô²»Í¬ÄØ£¿ ÒÑÓÐ1È˲ÎÓë

ÎÒ´òËãÓÃneb×ö¹ý¶É̬ËÑË÷Ñо¿£¬·¢ÏÖvaspµÄ³õ̬ºÍĩ̬£¬ÖмäµÄimagesÒ²ÐèÒª×Ô¼ºÊäÈ룬¶øpwscfÖ»Ðè¸ø¶¨³õ̬ºÍĩ̬ÒÔ¼°ÖмäµÄimagesµÄÊýÁ¿¾Í¿ÉÒÔ£¬²»Óøø³öimagesµÄ½á¹¹£¬ÕâÊÇÔõô»ØÊ°¡£¿
»Ø¸´´ËÂ¥

» ÊÕ¼±¾ÌûµÄÌÔÌûר¼­ÍƼö

µÚÒ»ÐÔÔ­Àí

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

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

jpchou

ר¼Ò¹ËÎÊ (ÖøÃûдÊÖ)

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¡ï ¡ï
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
fzx2008: ½ð±Ò+2, ллָµ¼ 2014-09-25 18:12:33
¾Í~
pwscf ±ÈÝ^ÙNÐÄ
Ëü•þŽÍÄã×öÖÐég images
VASP ±ÈÝ^‘Ð~ ÄãÒª×Ô¼ºœÊ‚äÖÐég images
2Â¥2014-09-25 16:14:55
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

hakuna

ľ³æ (ÖªÃû×÷¼Ò)

ÒýÓûØÌû:
2Â¥: Originally posted by jpchou at 2014-09-25 16:14:55
¾Í~
pwscf ±ÈÝ^ÙNÐÄ
Ëü•þŽÍÄã×öÖÐég images
VASP ±ÈÝ^‘Ð~ ÄãÒª×Ô¼ºœÊ‚äÖÐég images

¸÷ÓÐÀû±×°É£¬ÓÐʱºòÒÀÀµÏßÐÔ²åֵŪµÃimages¿ÉÄÜÓÐÊÕÁ²ÎÊÌ⣬×Ô¼º²åÈëimages»¹¿ÉÒÔÊÖ¶¯ÐÞ¸ÄÒ»ÏÂ
3Â¥2014-09-25 23:08:19
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ gaussian08 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] Ò»Ö¾Ô¸»ªÄÏÀí¹¤´óѧ331·Ö²ÄÁÏÇóµ÷¼Á +9 ÌìÏÂww 2026-04-09 9/450 2026-04-10 22:58 by Ftglcn90
[¿¼ÑÐ] Ò»Ö¾Ô¸Î÷±±¹¤Òµ´óѧ289 085602 +30 yangæÃ 2026-04-10 30/1500 2026-04-10 20:02 by jefferylhl
[¿¼ÑÐ] 307Çóµ÷¼Á +8 tzq94092 2026-04-10 8/400 2026-04-10 17:33 by 286640313
[¿¼ÑÐ] »·¾³×¨Ë¶µ÷¼Á +16 »á˵»°µÄÖâ×Ó 2026-04-06 16/800 2026-04-10 10:30 by asy1wn
[¿¼ÑÐ] ²ÄÁϸ´ÊÔÇóµ÷¼Á +20 xhhdjdjsjks 2026-04-09 20/1000 2026-04-10 10:25 by ËïСС12457
[¿¼ÑÐ] Çó +6 »¯¹¤×¨Ë¶323·Ö 2026-04-04 6/300 2026-04-10 10:04 by may_ÐÂÓî
[¿¼ÑÐ] һ־Ը˫·Ç085400µç×ÓÐÅÏ¢344 Çóµ÷¼Á£¬¶Ô²ÄÁϺͻ¯Ñ§·½ÏòÒ²¸ÐÐËȤ +8 ÎÞÇéµÄСÑò 2026-04-09 9/450 2026-04-10 09:30 by ËÉ»¨¸×1201
[¿¼ÑÐ] 085400µç×ÓÐÅÏ¢Àࣨ´¨´ó¿ØÖƹ¤³Ì£©Çóµ÷¼Á¿É¿çרҵ ÇóÀÏʦÁªÏµ +3 626776879 2026-04-08 3/150 2026-04-09 16:05 by Öí»á·É
[¿¼ÑÐ] 085501»úеӢ¶þ77×Ü·Ö294Çóµ÷¼Á£¬½ÓÊÜ¿çרҵѧϰ +6 ÊØ·¨¹«ÃñØÁ¼Í 2026-04-08 6/300 2026-04-09 15:55 by wp06
[¿¼ÑÐ] 322Çóµ÷¼Á£¬08¹¤¿Æ +3 ½ñÌìÊǸöСºÅ 2026-04-08 3/150 2026-04-09 15:53 by wp06
[¿¼ÑÐ] 368»¯Ñ§Çóµ÷¼Á +13 wwwwabcde 2026-04-07 14/700 2026-04-09 14:47 by heaven_jay
[¿¼ÑÐ] ²ÄÁÏ307·ÖÇó´óÀÐ×éÊÕÁô +17 Hllºú 2026-04-07 17/850 2026-04-09 10:53 by liuhuiying09
[¿¼ÑÐ] 288Çóµ÷¼Á +15 ûÓдð°¸_ 2026-04-05 15/750 2026-04-09 10:22 by 5268321
[¿¼ÑÐ] 308Çóµ÷¼Á +17 īīĮ 2026-04-06 17/850 2026-04-09 09:25 by Ò¼ÍùŸoǰ
[¿¼ÑÐ] 307Çóµ÷¼Á +3 Youth@@ 2026-04-07 3/150 2026-04-07 09:25 by СºÚ²»ÅÂÄÑ
[¿¼ÑÐ] 277¹¤¿ÆÇóµ÷¼Á +10 1915668 2026-04-04 11/550 2026-04-06 23:53 by ÐÄæÂÒâ±±
[¿¼ÑÐ] 348Çóµ÷¼Á +6 wukira 2026-04-04 6/300 2026-04-05 18:11 by Öí»á·É
[¿¼ÑÐ] µ÷¼Á +8 ÐܶþÏëÉϰ¶ 2026-04-04 8/400 2026-04-05 05:27 by houyaoxu
[¿¼ÑÐ] 290Çóµ÷¼Á +7 luoziheng 2026-04-04 7/350 2026-04-04 23:17 by lqwchd
[¿¼ÑÐ] ±¾¿Æ211£¬×¨Òµ085404£¬293·ÖÇëÇóµ÷¼Á +5 Á«²Ë¾ÍÊÇź°É 2026-04-04 5/250 2026-04-04 14:08 by ÕâÊÇÒ»¸öÎÞÁĵÄê
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û