| ²é¿´: 1369 | »Ø¸´: 9 | |||
cenwanglaiÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)
|
[½»Á÷]
¡¾ÇóÖúÍê±Ï¡¿ÆøÏà×ÔÓÉO2µÄÕñ¶¯²¨ÊýÎÄÏ×Öµ1600£¬ÎÒµÄÖ»ÓÐ1100¡£
|
||
|
Ò»°ãÇé¿ö£¬POTIM=0.015£¬NFREE=2¾Í¿ÉÒԵõ½ÆµÂʽá¹û¡£ ÄÇôPOTIM µÄȡֵÈçºÎÓ°ÏìÆµÂʼÆË㾫¶ÈÄØ£¿ NFREEÒ»°ãÉèΪ2.Ò²¿ÉÒÔÉèΪ4¡£ÕâÁ½ÖÖÉèÖ÷½·¨ÓкóÕßÒª¶àËã½üºõÒ»±¶µÄÀë×Ó²½Êý¡£µ«ÊÇÎÒ²âÊÔµÄÀý×ÓÁ½ÖÖÇé¿öOUTCARÖеÄÊä³öÊÇÒ»ÑùµÄÄØ¡£ÕâÁ½ÖÖÉèÖ÷½·¨¶ÔÊÇÈçºÎÌåÏÖÔÚ½á¹ûµÄµ¼³ö¹ý³ÌÉÏÄØ£¿ ÎÒÓÃO2·Ö×Ó·ÅÔÚ13AµÄboxÀïÃæ²âÊÔ£¬GGA+PW91, NFREE = 2, POTIM = 0.02, ENCUT = 480£¬K 1*1*1, µÃµ½ÉìËõÕñ¶¯²¨Êý1101cm^-1¡£ blochµÄÎÄÕÂÖÐÌáµ½PAW·½·¨ËãµÃµÄO2²¨ÊýÊÇ1600.ºÇºÇ£¬ÎÒ´íÁË¡£ÇëËã³ö1600µÄÌṩµã½¨Ò飡 ÖØÐÂËãÁËһϣ¬µÃµ½²¨Êý1560,ÒѾ²»´íÁË¡£ baidu googleÁËһϣ¬¾ÓȻûÓÐÕÒµ½Õâôֱ°×µÄO2·Ö×ÓÕñ¶¯²¨Êý¡£ Èç¹û·¢ÏÖ¼ÆËãÖµÓëʵÑéÖµÓÐЩ²î±ð£¬±ÈÈç30¸ö²¨Êý£¬Ôõôµ÷Õû¼ÆË㾫¶ÈÄØ£¿Ìá¸ß½á¹¹ÓÅ»¯¾«¶È£¿Ìá¸ßÄÜÁ¿ºÍÁ¦µÄ¼ÆË㾫¶È£¿ Ï£ÍûÌṩ²Î¿¼×ÊÁÏ£¬»òÕß½â´ð¡£ [ Last edited by cenwanglai on 2011-4-6 at 15:26 ] |
» ²ÂÄãϲ»¶
282Çóµ÷¼Á
ÒѾÓÐ5È˻ظ´
³ÏÕÐũҵ²©Ê¿
ÒѾÓÐ3È˻ظ´
²ÄÁÏѧ˶318Çóµ÷¼Á
ÒѾÓÐ9È˻ظ´
338Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
²ÄÁÏÓ뻯¹¤328Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
289Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
»¯¹¤270Çóµ÷¼Á
ÒѾÓÐ8È˻ظ´
һ־Ըɽ¶«´óѧ²ÄÁÏÓ뻯¹¤325Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
291 Çóµ÷¼Á
ÒѾÓÐ3È˻ظ´
0805×Ü·Ö292£¬Çóµ÷¼Á
ÒѾÓÐ8È˻ظ´
» ±¾Ö÷ÌâÏà¹ØÉ̼ÒÍÆ¼ö: (ÎÒÒ²ÒªÔÚÕâÀïÍÆ¹ã)
» ÇÀ½ð±ÒÀ²£¡»ØÌû¾Í¿ÉÒԵõ½:
µçÁ¦È«¹úÖØµãʵÑéÊÒ˫һÁ÷AÀ೤½Ñ§ÕßÍŶÓÕÐ2026ÄêÈ«ÈÕÖÆ²©Ê¿1-2Ãû
+2/130
Çú¸·Ê¦·¶´óѧÁõÖÐÇïÍŶÓÕл¯Ñ§¡¢²ÄÁÏ¿ÆÑ§Ó빤³Ìרҵµ÷¼ÁÉú
+1/84
Î÷°²¹¤³Ì´óѧ»·¾³Ó뻯ѧ¹¤³ÌѧԺ-ÍõÄþ¿ÎÌâ×éÕл¯Ñ§¡¢»·¾³¡¢ÉúÎïÏà¹Ø×¨ÒµË¶Ê¿2Ãû
+1/44
¹þ¹¤´óÖ£ÖÝÑо¿Ôº²éÕý±¦Ñо¿Ô±ÕÐÊÕ²©Ê¿Éú¼ÓÃË
+1/43
Öйú¼ÆÁ¿¿ÆÑ§Ñо¿Ôº³¤¶ÈÁ¿×Ó»ù׼ʵÑéÊÒ2026Äêµ÷¼ÁÕÐÉú
+1/43
¡¾²©Ê¿ÕÐÉú¡¿±±·½¹¤Òµ´óѧÕÐÊÕ»úе¹¤³Ì·½ÏòÉêÇ뿼ºËÖÆ²©Ê¿
+1/38
ÕÐÆ¸¼ÆË㻯ѧ/Ò©ÎïÉè¼Æ¿ÆÑ§¼Ò
+1/37
Çൺ¿Æ¼¼´óѧ2026Äê¸ß·Ö×Ó²ÄÁÏ·½Ïò¿ÆÑÐÖúÀíÕÐÆ¸
+1/32
look 26½ì || ¼ÆËã»ú¡¢µç×ÓÐÅÏ¢Àà¡¢µç¿Æ¡¢¿ØÖÆ¡¢Í¨ÐÅ¿¼ÑÐT jÐÅÏ¢´¼£º1o33 7747 o3
+1/20
ͬ¼Ã´óѧ»·¾³Ñ§ÔºÐ¤Ù»Ñо¿Ô±ÕÐÊÕ2026Äê˶ʿÑо¿Éú
+1/17
¡¾¼ÓÄô󿨶û¶Ù´óѧ¡¿Õв©Ê¿Éú¡¾ÐÄÀíѧÈ˹¤ÖÇÄÜ¡¿
+1/15
¡¾Çൺ´óѧ¡¿2026ÄêÉúÎïÓëÒ½Ò©ÉêÇ뿼ºËÖÆ²©Ê¿ÉúÕÐÉú£¨º¬ÉÙÊýÃñ×å¹Ç¸ÉÈ˲ţ©
+1/12
ÉÂÎ÷¿Æ¼¼´óѧ2026Ä격ʿÑо¿ÉúÕÐÉú
+1/10
26½ì¼ÆËã»ú¡¢µç×ÓÐÅÏ¢Àà¡¢µç¿Æ¡¢¿ØÖÆ¡¢Í¨ÐÅ¿¼ÑÐT jÐÅÏ¢´¼£º10+33+77+47+03
+1/8
26½ì¼ÆËã»ú¡¢µç×ÓÐÅÏ¢Àà¡¢µç¿Æ¡¢¿ØÖÆ¡¢Í¨ÐÅ¿¼ÑÐT jÐÅÏ¢´¼£º10+33+77+47+03
+1/8
look 26½ì¼ÆËã»ú¡¢µç×ÓÐÅÏ¢Àà¡¢µç¿Æ¡¢¿ØÖÆ¡¢Í¨ÐÅ¿¼ÑÐT jÐÅÏ¢´¼£º10+33+77+47+03
+1/7
¡¾È«½±²©Ê¿ÕÐÉú¡¿ÃÀ¹ú¿ÆÂÞÀ¶à´óѧ¿ÆÂÞÀ¶à˹ÆÕÁÖ˹·ÖУ----¹ÌÌåÓë½á¹¹Á¦Ñ§
+1/4
277Çóµ÷¼Á
+1/4
2026É격×Ô¼ö
+1/3
Ai-MOFsÐÔÄÜÔ¤²âɸѡ¼¼Êõ
+1/1
¡ï
cenwanglai(½ð±Ò+2): ºÇºÇ£¬Ð»Ð»»Ø¸´¡£ 2011-04-01 11:11:25
sunyang1988(½ð±Ò+1): лл½»Á÷ 2011-04-01 11:28:18
cenwanglai(½ð±Ò+2): ºÇºÇ£¬Ð»Ð»»Ø¸´¡£ 2011-04-01 11:11:25
sunyang1988(½ð±Ò+1): лл½»Á÷ 2011-04-01 11:28:18
| Ö»²î30¸ö²¨Êý ÄÇÒѾºÜ¾«È·ÁË |
2Â¥2011-04-01 11:06:56
cenwanglai
ÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)
- 1STÇ¿Ìû: 5
- Ó¦Öú: 46 (СѧÉú)
- ¹ó±ö: 8.842
- ½ð±Ò: 7440.4
- Ìû×Ó: 5306
- ÔÚÏß: 1961.4Сʱ
- ³æºÅ: 537452
3Â¥2011-04-01 11:12:15
4Â¥2011-04-01 11:15:56
cenwanglai
ÈÙÓþ°æÖ÷ (ÖªÃû×÷¼Ò)
- 1STÇ¿Ìû: 5
- Ó¦Öú: 46 (СѧÉú)
- ¹ó±ö: 8.842
- ½ð±Ò: 7440.4
- Ìû×Ó: 5306
- ÔÚÏß: 1961.4Сʱ
- ³æºÅ: 537452
|
ºÇºÇ£¬ÎÒÔõô¾õµÃÓ¦¸ÃÊÇÎü¸½Ô½Ç¿£¬²¨ÊýÔ½Ð¡ÄØ£¿Îü¸½Ç¿ÁË£¬·Ö×ÓÕñ¶¯»Ø¸´Á¦Ô½´ó£¬ÆµÂÊÔ½¸ß£¬²¨ÊýԽС¡£ ÁíÍ⣺ Îü¸½Ì¬²¨Êý<×ÔÓÉ̬ ¸üÈõÎü¸½Ì¬->×ÔÓÉ̬ Ç¿Îü¸½Ì¬²¨Êý<ÈõÎü¸½Ì¬²¨Êý *************Á¢´Ë´æÕÕ********** ºÇºÇ£¬ÎÒ´íÁË¡£ÆµÂÊ Õý±ÈÓÚÆµÂÊ£¬·´±ÈÓÚ²¨³¤¡£ [ Last edited by cenwanglai on 2011-4-1 at 11:55 ] |
5Â¥2011-04-01 11:22:31
¡ï
sunyang1988(½ð±Ò+1): лл½»Á÷ 2011-04-01 11:29:17
sunyang1988(½ð±Ò+1): лл½»Á÷ 2011-04-01 11:29:17
|
ûÎÊÌâ°¡£¬Îü¸½Ô½Ç¿£¬O-O ¼ü¾ÍÔ½Èõ£¬²¨Êý¾ÍԽС¡£ |
6Â¥2011-04-01 11:25:55
sunyang1988
ÖÁ×ðľ³æ (ÖøÃûдÊÖ)
- 1STÇ¿Ìû: 1
- Ó¦Öú: 24 (СѧÉú)
- ¹ó±ö: 0.984
- ½ð±Ò: 9397.7
- Ìû×Ó: 1744
- ÔÚÏß: 1255.8Сʱ
- ³æºÅ: 965316
7Â¥2011-04-01 11:29:36
¼òµ¥»Ø¸´
°Íɽ»¢8Â¥
2011-04-01 11:34
»Ø¸´
Ö§³Ö£¡
cenwanglai9Â¥
2011-04-03 09:03
»Ø¸´
cenwanglai10Â¥
2011-04-06 13:09
»Ø¸´













»Ø¸´´ËÂ¥