| ²é¿´: 1202 | »Ø¸´: 26 | |||
| µ±Ç°Ö÷ÌâÒѾ´æµµ¡£ | |||
| µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû | |||
yncuiyanľ³æ (СÓÐÃûÆø)
|
[½»Á÷]
[ÇóÖú]MS¶¯Á¦Ñ§Ä£ÄâµÄÎÊÌâ
|
||
|
ÎÒÔÚÓÃamorphous cellÄ£¿é¹¹½¨ÁËÒ»¸öº¬1100¸ö·Ö×ӵĺÐ×Ó£¬¿ÉÊǽá¹û³öÏÖ´íÎ󣬾ßÌåÈçÏ£º Error: Dynamics: Energy difference between successive steps in dynamics is greater than the user defined variable DEVIATION, 5000.000 while executing "dynamics time = 100000 timestep = 1.0 initial_temperature = 298.00 +boltzmann ensemble = NVT temperature_control_method = velocity_scaling integra ..." ("while" body line 10) invoked from within "while {[readFile archive frame = $iframe filename = $arcname] != ""} { echo "\n******************************" echo "Processing fr ..." ÇëÎÊÕâ¸öÊÇʲôÎÊÌ⣿ÊÇÓÉʲôÒýÆðµÄ£¬ÔõôÑùÄܹ»½â¾öÕâ¸ö´íÎó£¿ ÏÈлл¸÷λ [ Last edited by yncuiyan on 2009-3-4 at 10:28 ] |
» ²ÂÄãϲ»¶
һ־Ը³¶«´óѧ071000ÉúÎïѧѧ˶³õÊÔ·ÖÊý276Çóµ÷¼Á
ÒѾÓÐ30È˻ظ´
327Çóµ÷¼Á
ÒѾÓÐ25È˻ظ´
ҩѧÇóµ÷¼Á
ÒѾÓÐ11È˻ظ´
Çóµ÷¼Á
ÒѾÓÐ12È˻ظ´
ͨÐŹ¤³ÌÇóµ÷¼Á£¡£¡£¡
ÒѾÓÐ4È˻ظ´
²ÄÁϹ¤³Ì085601£¬270Çóµ÷¼Á
ÒѾÓÐ46È˻ظ´
ҩѧ305Çóµ÷¼Á
ÒѾÓÐ5È˻ظ´
Ò»Ö¾Ô¸211£¬»¯Ñ§310·Ö£¬±¾¿ÆÖصãË«·Ç£¬Çóµ÷¼Á
ÒѾÓÐ24È˻ظ´
272·Ö²ÄÁÏ×ÓÇóµ÷¼Á
ÒѾÓÐ54È˻ظ´
085500Çóµ÷¼Á²ÄÁÏ
ÒѾÓÐ11È˻ظ´
» ±¾Ö÷ÌâÏà¹ØÉ̼ÒÍÆ¼ö: (ÎÒÒ²ÒªÔÚÕâÀïÍÆ¹ã)
yncuiyan
ľ³æ (СÓÐÃûÆø)
- Ó¦Öú: 1 (Ó×¶ùÔ°)
- ½ð±Ò: 1799.9
- É¢½ð: 2
- Ìû×Ó: 168
- ÔÚÏß: 73.3Сʱ
- ³æºÅ: 485872
- ×¢²á: 2007-12-27
- רҵ: ÓÐÉ«½ðÊôÒ±½ð
4Â¥2009-03-04 09:03:45
qasd
ľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 0 (Ó×¶ùÔ°)
- ¹ó±ö: 2.634
- ½ð±Ò: 3221.8
- ºì»¨: 6
- Ìû×Ó: 2009
- ÔÚÏß: 130.3Сʱ
- ³æºÅ: 239620
- ×¢²á: 2006-04-07
¡ï
wuli8(½ð±Ò+1,VIP+0):(*^__^*) 3-5 09:27
wuli8(½ð±Ò+1,VIP+0):(*^__^*) 3-5 09:27
|
ÄÜÁ¿Ì«¸ß£¬ÏÈ×îС»¯ÔÙ¶¯Á¦Ñ§¼ÆËã constructionʱºòÏÂÃæÄǸö²»Òª´ò¹´ |
2Â¥2009-03-03 20:19:03
yncuiyan
ľ³æ (СÓÐÃûÆø)
- Ó¦Öú: 1 (Ó×¶ùÔ°)
- ½ð±Ò: 1799.9
- É¢½ð: 2
- Ìû×Ó: 168
- ÔÚÏß: 73.3Сʱ
- ³æºÅ: 485872
- ×¢²á: 2007-12-27
- רҵ: ÓÐÉ«½ðÊôÒ±½ð
3Â¥2009-03-03 21:56:56
µãµã¶ù
½ð³æ (СÓÐÃûÆø)
- Ó¦Öú: 0 (Ó×¶ùÔ°)
- ½ð±Ò: 663.8
- ºì»¨: 1
- Ìû×Ó: 133
- ÔÚÏß: 1.9Сʱ
- ³æºÅ: 626185
- ×¢²á: 2008-10-14
5Â¥2009-03-04 09:52:00














»Ø¸´´ËÂ¥