²é¿´: 960  |  »Ø¸´: 3
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

snowmami

гæ (ÕýʽдÊÖ)

[½»Á÷] ¡¾ÇóÖú¡¿MS5.0°²×°ºóÎÞ·¨¼ÆËã ÒÑÓÐ3È˲ÎÓë

ÎÒ½ñÌìÔÚµçÄÔÉϰ²×°ÁËMS5.0£¬licensesÎļþÒ²°²×°ÉÏÁË¡£
µ«ÊÇÔÚ½¨Ä£ºóÎÞ·¨¿´µ½ÈýάµÄÄ£ÐÍ£¨Ä£ÐÍÎÞ·¨ÓÃÊó±êÍ϶¯£©£¬Ò²ÎÞ·¨¼ÆËã¡£³öÏÖÁËÒ»ÏÂÌáʾÐÅÏ¢£º
CASTEP cannot calculate core level spectra without on the fly generated pseudopotentials:
Please use on the fly generated pseudopotential for at least one element.
²»ÖªÊÇʲôԭÒò£¬ÆÚ´ý´ïÈ˰ïÖú£¡
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

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

yingyw

Í­³æ (³õÈëÎÄ̳)

ÎÒµÄÒ²²»ÄÜË㣬Ê×ÏÈ˵gatewayÓÐÎÊÌ⣬¸Ä¹ýºó£¬»¹ÊÇÔËÐв»ÁË
3Â¥2010-06-24 16:23:40
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 4 ¸ö»Ø´ð

zzy870720z

ÈÙÓþ°æÖ÷ (ÎÄ̳¾«Ó¢)

ÓÅÐã°æÖ÷ÓÅÐã°æÖ÷ÓÅÐã°æÖ÷ÓÅÐã°æÖ÷

¡ï
cenwanglai(½ð±Ò+1):лл»Ø¸´! 2010-06-12 09:00:27
²»ÄܼÆËãÌáʾÄãҪʹÓÃon the flyÐ͵Äpotential
Äã¸ÄÒ»ÏÂÊÔÊÔ

ÖÁÓÚ²»ÄÜÏÔʾ£¬×îºÃÉÏͼ¿´¿´£¬²»Çå³þʲôԭÒò

[ Last edited by zzy870720z on 2010-6-11 at 19:32 ]
²©Ñ§¡¢ÉóÎÊ¡¢É÷˼¡¢Ã÷±æ¡¢óÆÑ§
2Â¥2010-06-11 19:28:41
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

snowmami

гæ (ÕýʽдÊÖ)

лл´ó¼Ò£¬ÎÊÌâûÓнâ¾ö£¬ÖØ×°ºó¿ÉÒÔ¼ÆËã
4Â¥2010-06-24 17:16:40
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] Ò»Ö¾Ô¸Ìì½ò´óѧ»¯Ñ§¹¤ÒÕרҵ£¨081702£©315·ÖÇóµ÷¼Á +7 yangfz 2026-03-17 7/350 2026-03-17 23:57 by ÐÇ¿ÕÐÇÔÂ
[¿¼ÑÐ] ÄÜÔ´²ÄÁÏ»¯Ñ§¿ÎÌâ×éÕÐÊÕ˶ʿÑо¿Éú8-10Ãû +3 ÍÑÓ±¶ø³ö 2026-03-16 6/300 2026-03-17 21:19 by z1z2z3879
[¿¼ÑÐ] 344Çóµ÷¼Á +4 knight344 2026-03-16 4/200 2026-03-17 17:27 by ruiyingmiao
[¿¼ÑÐ] 332Çóµ÷¼Á +6 Zz°æ 2026-03-13 6/300 2026-03-17 17:03 by ruiyingmiao
[¿¼ÑÐ] ¶«ÄÏ´óѧ364Çóµ÷¼Á +5 JasonYuiui 2026-03-15 5/250 2026-03-16 21:28 by ľ¹Ï¸à
[¿¼ÑÐ] »úеר˶325£¬Ñ°ÕÒµ÷¼ÁԺУ +3 y9999 2026-03-15 5/250 2026-03-16 19:58 by y9999
[¿¼ÑÐ] »·¾³¹¤³Ìµ÷¼Á +6 ´ó¿Édigkids 2026-03-16 6/300 2026-03-16 17:16 by barlinike
[¿¼ÑÐ] Ò»Ö¾Ô¸211 0703·½Ïò310·ÖÇóµ÷¼Á +3 ŬÁ¦·Ü¶·112 2026-03-15 3/150 2026-03-16 16:44 by houyaoxu
[¿¼²©] ¶«»ªÀí¹¤´óѧ»¯²Äרҵ26½ì˶ʿ²©Ê¿ÉêÇë +6 zlingli 2026-03-13 6/300 2026-03-15 20:00 by ryzcf
[¿¼ÑÐ] 289Çóµ÷¼Á +4 ÕâôÃû×ÖÕ¦Ñù 2026-03-14 6/300 2026-03-14 18:58 by userper
[»ù½ðÉêÇë] ÏÖÔÚÈçºÎ»Ø±ÜÈ¥ÄêµÄijһ¸öר¼Ò£¬²»ÖªµÀÃû×Ö +3 zk200107 2026-03-12 6/300 2026-03-14 17:13 by zk200107
[¿¼ÑÐ] 304Çóµ÷¼Á +7 7712b 2026-03-13 7/350 2026-03-13 21:42 by peike
[¿¼ÑÐ] Çóµ÷¼Á +7 18880831720 2026-03-11 7/350 2026-03-13 16:10 by JourneyLucky
[¿¼ÑÐ] ¹¤¿Æ278·ÖÇóµ÷¼Á +5 ÖÜÂýÈȰ¡ 2026-03-12 7/350 2026-03-13 15:49 by JourneyLucky
[¿¼ÑÐ] ¹¤¿Æ²ÄÁÏ085601 279Çóµ÷¼Á +8 À§ÓÚÐdz¿ 2026-03-12 10/500 2026-03-13 15:42 by ms629
[¿¼ÑÐ] 274Çóµ÷¼Á +3 S.H1 2026-03-12 3/150 2026-03-13 15:15 by JourneyLucky
[¿¼ÑÐ] ¹¤¿Æµ÷¼Á +4 Jiang191123£¡ 2026-03-11 4/200 2026-03-13 15:15 by Miko19
[¿¼ÑÐ] ²ÄÁÏ301·ÖÇóµ÷¼Á +5 Liyouyumairs 2026-03-12 5/250 2026-03-13 14:42 by JourneyLucky
[¿¼ÑÐ] 277Çóµ÷¼Á +4 anchor17 2026-03-12 4/200 2026-03-13 11:15 by °×Ò¹ÓÆ³¤
[¿¼ÑÐ] 270Çóµ÷¼Á 085600²ÄÁÏÓ뻯¹¤×¨Ë¶ +3 YXCT 2026-03-11 3/150 2026-03-13 10:13 by houyaoxu
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û