²é¿´: 1734  |  »Ø¸´: 10
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

jiafeimao236

Òø³æ (ÕýʽдÊÖ)

[ÇóÖú] MS demolÄ£ÄâÓлúÎï¸ßηֽ⣬ΪʲôÎÒÄ£Äâ³öµÄ½á¹ûÊÇ»¯Ñ§¼ü¶ÏÁÑÖ®ºóÈ»ºóÓÖ¸´ºÏ£¿

MS demolÄ£ÄâÓлúÎï¸ßηֽ⣬ΪʲôÎÒÄ£Äâ³öµÄ½á¹ûÊÇ»¯Ñ§¼ü¶ÏÁÑÖ®ºóÈ»ºóÓÖ¸´ºÏ£¿ÎÒ¿´ÎÄÕÂÖеĽá¹û¶¼ÊÇÔ½À´Ô½ÑÏÖØ£¬¼ü¶ÏÁѵÄÔ½À´Ô½¶àÄØ£¿£¿
ÄÄÀïÉèÖÃÓÐÎÊÌâÂð£¿
ÐÂÊÖ£¬ÇóÖ¸µ¼£¡
»Ø¸´´ËÂ¥
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

jiafeimao236

Òø³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
2Â¥: Originally posted by smutao at 2014-01-19 21:37:53
Â¥Ö÷Äܲ»ÄܰÑÄã×öµÄ´ó¸Å¹ý³ÌÃèÊöÒ»ÏÂ
ÎҲ²âÊÇÒòΪζȿØÖÆÓÐÎÊÌâ

ÎÒ½¨ÍêÄ££¬ÓÃdmol½øÐÐÁËÓÅ»¯£¬È»ºó½øÐÐdynamics¼ÆË㣬ÉèÖòÎÊýÈçÏ£º
ensemble£ºNVT£¬Temperature£º900K£¬Time step£º1fs£¬total simulation time£º0.5ps£¬Thermostat£ºSimple NH Functional£º GGA£¬BLYP
3Â¥2014-01-19 21:59:34
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 11 ¸ö»Ø´ð

smutao

½û³æ (ÖøÃûдÊÖ)

¡ï
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
ÔÂÖ»À¶: ½ð±Ò+1, ¹ÄÀø½»Á÷ 2014-01-20 15:00:34
±¾ÌûÄÚÈݱ»ÆÁ±Î

2Â¥2014-01-19 21:37:53
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

jiafeimao236

Òø³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
2Â¥: Originally posted by smutao at 2014-01-19 21:37:53
Â¥Ö÷Äܲ»ÄܰÑÄã×öµÄ´ó¸Å¹ý³ÌÃèÊöÒ»ÏÂ
ÎҲ²âÊÇÒòΪζȿØÖÆÓÐÎÊÌâ

Ö÷ÒªÊÇÎÒ¸Õ½Ó´¥Õâ¸öÈí¼þ£¬²ÎÊý²»ÖªµÀʲôÒâ˼¡£ÆäÓà²ÎÊý»¹ÐèÒªÌØÊâÉèÖÃÂð£¿ÕæµÄÊǷdz£¸ÐлÄúµÄ¹Ø×¢¡£
4Â¥2014-01-19 22:05:27
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

jiafeimao236

Òø³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
2Â¥: Originally posted by smutao at 2014-01-19 21:37:53
Â¥Ö÷Äܲ»ÄܰÑÄã×öµÄ´ó¸Å¹ý³ÌÃèÊöÒ»ÏÂ
ÎҲ²âÊÇÒòΪζȿØÖÆÓÐÎÊÌâ

ÕâÊÇÎÒÆäËüһЩ²ÎÊýµÄÉèÖã¬ÄúÄܰïÎÒ¿´ÏÂÂð£¿
MS demolÄ£ÄâÓлúÎï¸ßηֽ⣬ΪʲôÎÒÄ£Äâ³öµÄ½á¹ûÊÇ»¯Ñ§¼ü¶ÏÁÑÖ®ºóÈ»ºóÓÖ¸´ºÏ£¿
IMG_Ali_00109.jpg


MS demolÄ£ÄâÓлúÎï¸ßηֽ⣬ΪʲôÎÒÄ£Äâ³öµÄ½á¹ûÊÇ»¯Ñ§¼ü¶ÏÁÑÖ®ºóÈ»ºóÓÖ¸´ºÏ£¿-1
IMG_Ali_00110.jpg

5Â¥2014-01-19 22:21:57
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 328Çóµ÷¼Á£¬Ó¢ÓïÁù¼¶551£¬ÓпÆÑо­Àú +3 ÉúÎ﹤³Ìµ÷¼Á 2026-03-17 7/350 2026-03-18 20:41 by Wangjingyue
[¿¼ÑÐ] Ò»Ö¾Ô¸Ìì½ò´óѧ»¯Ñ§¹¤ÒÕרҵ£¨081702£©315·ÖÇóµ÷¼Á +10 yangfz 2026-03-17 10/500 2026-03-18 20:14 by walc
[¿¼ÑÐ] Ò»Ö¾Ô¸Öк£Ñó²ÄÁϹ¤³Ìר˶330·ÖÇóµ÷¼Á +4 С²Ä»¯±¾¿Æ 2026-03-18 4/200 2026-03-18 19:54 by Î޼ʵIJÝÔ­
[¿¼ÑÐ] 354Çóµ÷¼Á +3 Tyoumou 2026-03-18 5/250 2026-03-18 16:41 by Tyoumou
[¿¼ÑÐ] Ò»Ö¾Ô¸Ìì´ó²ÄÁÏÓ뻯¹¤£¨085600£©×Ü·Ö338 +3 ²Ì´óÃÀÅ® 2026-03-13 3/150 2026-03-18 15:53 by jhhcooi
[¿¼ÑÐ] 281Çóµ÷¼Á£¨0805£© +5 ÑÌÏ«Ò亣 2026-03-16 13/650 2026-03-18 14:30 by stone_128
[¿¼ÑÐ] 0703»¯Ñ§µ÷¼Á £¬Áù¼¶Òѹý£¬ÓпÆÑо­Àú +10 êØÎõÙâ 2026-03-15 10/500 2026-03-18 14:19 by 007_lilei
[¿¼ÑÐ] 278Çóµ÷¼Á +5 ÑÌ»ðÏÈÓÚ´º 2026-03-17 5/250 2026-03-18 08:43 by ÐÇ¿ÕÐÇÔÂ
[»ù½ðÉêÇë] ±»ÎÒÑÔÖУºÐÂÄ£°å²»Ç¿µ÷¸ñʽÁË£¬¼Ùר¼Ò¿ªÊ¼¹Ü¸ñʽÁË +4 beefly 2026-03-14 4/200 2026-03-17 22:04 by »ÆÄñÓÚ·ÉChao
[¿¼ÑÐ] 085600²ÄÁÏÓ뻯¹¤Çóµ÷¼Á +5 Ð÷ÐÒÓë×Ó 2026-03-17 5/250 2026-03-17 16:40 by laoshidan
[¿¼ÑÐ] 283Çóµ÷¼Á +3 Ìý·ç¾ÍÊÇÓꣻ 2026-03-16 3/150 2026-03-17 07:41 by ÈÈÇéɳĮ
[¿¼ÑÐ] 085600µ÷¼Á +5 ÑúÑú123sun 2026-03-12 6/300 2026-03-16 15:58 by ÑúÑú123sun
[¿¼ÑÐ] 0703 ÎïÀí»¯Ñ§µ÷¼Á +3 ÎÒ¿ÉÒÔÉϰ¶µÄ¶Ô 2026-03-13 5/250 2026-03-16 10:50 by ÎÒ¿ÉÒÔÉϰ¶µÄ¶ÔÂ
[¿¼ÑÐ] 326Çóµ÷¼Á +3 mlpqaz03 2026-03-15 3/150 2026-03-16 07:33 by Iveryant
[¿¼ÑÐ] 0856ר˶279Çóµ÷¼Á +5 ¼ÓÓͼÓÓÍ£¡? 2026-03-15 5/250 2026-03-15 11:58 by 2020015
[¿¼ÑÐ] ±¾¿ÆÄϾ©´óѧһ־Ը´¨´óҩѧ327 +3 ÂóÌï¸ûÕß 2026-03-14 3/150 2026-03-14 20:04 by ÍâÐÇÎÄÃ÷
[¿¼ÑÐ] 297Çóµ÷¼Á +4 ѧº£Æ¯²´ 2026-03-13 4/200 2026-03-14 11:51 by ÈÈÇéɳĮ
[¿¼ÑÐ] £Û0860£Ý321·ÖÇóµ÷¼Á£¬abÇø½Ô¿É +4 ±¦¹óÈÈ 2026-03-13 4/200 2026-03-13 22:01 by ÐÇ¿ÕÐÇÔÂ
[¿¼ÑÐ] 311Çóµ÷¼Á +3 ¶¬Ê®Èý 2026-03-13 3/150 2026-03-13 20:41 by JourneyLucky
[¿¼ÑÐ] ²ÄÁÏר˶350 Çóµ÷¼Á +4 Íõ½ð¿Æ 2026-03-12 4/200 2026-03-13 16:02 by ruiyingmiao
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û