Znn3bq.jpeg
²é¿´: 1364  |  »Ø¸´: 4
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

leanner

Ìú³æ (³õÈëÎÄ̳)

[ÇóÖú] MSµÄCASTEP¼ÆËãʱ¼äÎÊÌ⣬ÇóÖú

MS³õѧÕßһö£¬×î½üÔÚ¿´Èí¼þ×Ô´ø°ïÖúÎļþ£¬ÆäÖÐTutorialsϵÄCASTEP tutorialsÀïÃæ£¬°´ÕÕAdsorption of CO onto a Pd(110) surfaceÕâ¸ö²Ù×÷ÁËÒ»±é£¬ÔÚÓÅ»¯Pd(110)±íÃæµÄ²½ÖèÖУ¬ÔËÐÐCASTEP£¬´Ó×òÌì19:10¿ªÊ¼£¬Ò»Ö±ÔËÐе½ÏÖÔÚ»¹Ã»ÓнáÊø£¬ÒѾ­¹ýÈ¥26¸öСʱ¡£

ÏëÎÊÒ»ÏÂÕâ¸ö²½ÖèµÄÓÅ»¯¼ÆËã±¾À´¾ÍºÜÂý£¬»¹ÊÇÆäËûÎÊÌ⣬Çó½â´ð¡£

¸½ÉÏÏà¹ØÐÅÏ¢
µçÄÔÅäÖãº
¿áî£i5 520 Ë«ºË2.40GHz
ÄÚ´æ4G

CASTEP ÉèÖÃΪ4 cores
Ö»¼ÆËã̬ÃܶÈ

ÈÎÎñ¹ÜÀíÆ÷²é¿´µ½cpu4¸öºËÐĵÄʹÓÃÂʶ¼ÔÚ88%×óÓÒ£¬½ø³ÌÁбíÖпÉÒÔ¿´µ½Á½¸öcastepexe.exeÔÚÔËÐС£
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
±¾ÌûÄÚÈݱ»ÆÁ±Î

4Â¥2022-04-06 11:55:07
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 5 ¸ö»Ø´ð

»­ÐÄ

½ð³æ (СÓÐÃûÆø)

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¡ï ¡ï ¡ï ¡ï ¡ï ¡ï
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
identation: ½ð±Ò+1, лл»ØÌû 2013-10-13 12:02:32
leanner: ½ð±Ò+5, ¡ï¡ï¡ïºÜÓаïÖú 2013-10-14 12:38:56
û°¡£¬¸ú×ÅÄǸö½Ì°¸ÉèµÄ²ÎÊý£¬ÎÒÔÚCPÉ϶¼Ö»ËãÁ˼¸·ÖÖÓ
2Â¥2013-10-13 09:49:09
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

leanner

Ìú³æ (³õÈëÎÄ̳)

ÒýÓûØÌû:
2Â¥: Originally posted by »­ÐÄ at 2013-10-13 09:49:09
û°¡£¬¸ú×ÅÄǸö½Ì°¸ÉèµÄ²ÎÊý£¬ÎÒÔÚCPÉ϶¼Ö»ËãÁ˼¸·ÖÖÓ

ÎÒÒѾ­Í£ÁË£¬ÖØÐÂÀ´Ò»±éÊÔÊÔ¡£
3Â¥2013-10-13 10:58:22
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
±¾ÌûÄÚÈݱ»ÆÁ±Î

5Â¥2022-04-08 17:33:56
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] Ò»Ö¾Ô¸¹þ¹¤´ó 085600 277 12²Ä¿Æ»ùÇóµ÷¼Á 5+5 chenny174 2026-04-10 24/1200 2026-04-12 02:39 by Çï¶¹²ËÑ¿
[¿¼ÑÐ] Ò»Ö¾Ô¸Ö£ÖÝ´óѧ 22408 305·ÖÇóµ÷¼Á +5 °²Ð¡Âúzzz 2026-04-08 5/250 2026-04-12 00:41 by À¶ÔÆË¼Óê
[¿¼ÑÐ] Çóµ÷¼Á +13 ÕÅ·¬ÇѲ»³´µ° 2026-04-10 14/700 2026-04-11 16:02 by vgtyfty
[¿¼ÑÐ] 269µç×ÓÐÅÏ¢Çóµ÷¼Á£¬¿Éתרҵ +11 ¶À×Ãwl 2026-04-06 11/550 2026-04-11 11:12 by ÄæË®³Ë·ç
[¿¼ÑÐ] 0854µ÷¼Á +5 ÒôÏñµêÌý»¨¹ÄÏ· 2026-04-10 5/250 2026-04-11 10:49 by qingpingzhu
[¿¼ÑÐ] 297Çóµ÷¼Á +9 Kwgyz 2026-04-09 9/450 2026-04-11 10:09 by zhq0425
[¿¼ÑÐ] 22408 327·ÖÇóµ÷¼Á +4 ÔÏ·çkon 2026-04-10 4/200 2026-04-11 09:51 by Öí»á·É
[¿¼ÑÐ] 342µç×ÓÐÅϢר˶Çóµ÷¼Á +9 ÄãÈÃÎÒÔõôÀóÖ¦ 2026-04-10 10/500 2026-04-11 08:33 by zhq0425
[¿¼ÑÐ] Ò»Ö¾Ô¸¿ó´ó£¬²ÄÁϹ¤³Ìר˶314·Ö£¬0856¿Éµ÷¶¼¿ÉÒÔ +15 ÎÞи¿É»÷µÄ¾ÞÈË 2026-04-09 15/750 2026-04-10 18:10 by hmn_wj
[¿¼ÑÐ] 273Çóµ÷¼Á +51 ÂóС¶£µ± 2026-04-06 58/2900 2026-04-10 15:54 by jiajinhpu
[¿¼ÑÐ] Ò»Ö¾Ô¸»ª¶«Ê¦·¶ÉúÎïѧ326·Ö£¬Çóµ÷¼Á +8 Áõīī 2026-04-09 8/400 2026-04-10 12:00 by pengliang8036
[¿¼ÑÐ] Çóµ÷¼Á ²ÄÁÏÓ빤³Ì 324·Ö ר˶ +19 ôæôæÒ»ÊéÉú 2026-04-10 21/1050 2026-04-10 11:41 by wp06
[¿¼ÑÐ] ²ÄÁÏר˶(0856) 339·ÖÇóµ÷¼Á +9 ¹þ¹þ¹þ¶ì¹þ¹þ¹þ 2026-04-09 10/500 2026-04-09 20:01 by Orcid
[¿¼ÑÐ] 367Çóµ÷¼Á +10 hffQAQ 2026-04-09 10/500 2026-04-09 18:06 by lijunpoly
[¿¼ÑÐ] һ־Ը³¶«´óѧ071000ÉúÎïѧѧ˶³õÊÔ·ÖÊý276Çóµ÷¼Á +3 Ľ¾øcc 2026-04-09 3/150 2026-04-09 09:57 by liuhuiying09
[¿¼ÑÐ] ר˶0854³õÊÔ¿¼²Ä¿Æ»ù£¬Çóµ÷¼Á +7 3220548044 2026-04-06 10/500 2026-04-08 21:59 by hypershenger
[¿¼ÑÐ] Ò»Ö¾Ô¸ÄϿƴóÉúÎïѧ297·Ö£¬Çóµ÷¼ÁÍÆ¼ö +8 Y-yyusx 2026-04-06 9/450 2026-04-07 19:38 by biomichael
[¿¼ÑÐ] 316Çóµ÷¼Á +7 yyxÏëµ÷¼Á 2026-04-05 7/350 2026-04-07 14:31 by shdgaomin
[¿¼ÑÐ] µ÷¼Á +4 mcbbc 2026-04-06 5/250 2026-04-07 12:33 by upczlm1989
[¿¼ÑÐ] ÐŹ¤Ëù11408 340·Ö ±¾¿ÆÎ÷°²½»´ó×Ô¶¯»¯ +3 moontrek 2026-04-06 3/150 2026-04-07 09:56 by chongya
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û