²é¿´: 1762  |  »Ø¸´: 2

°¢Èý°¢Àﱦ±¦

гæ (³õÈëÎÄ̳)

[ÇóÖú] LAMMPS special_bonds Ó÷¨

LAMMPSÊÖ²áÉÏ˵£¬special_bondsÃüÁîÊǸø1-2,1-3,1-4Ï໥×÷ÓõÄÉè¶¨È¨ÖØÏµÊý£¬µ«ÊÇimportant note ²¿·ÖÎÒʵÔÚÊÇ¿´²»¶®ËµµÄÊÇʲô£¬Çë¸÷λ¸ø½âÊÍϰ¡¡£»¹ÓУ¬Èç¹ûweighted coefficients ¶¼ÉèΪ0£¬ÊDz»ÊǾͲ»»á¼ÆËãpair£¬angleºÍdihedralÊÆÄÜÁËÄØ£¿ÄÇÑùµÄ»°£¬ÊDz»ÊÇinÎļþÀﶨÒåµÄpair£¬angleºÍdihedralÊÆÄܲ¿·Ö¾Í²»»áÆð×÷ÓÃÁË£¿ÔÚʲôÇé¿öÏ£¬¿ÉÒÔÓõ½Õâ¸öÃüÁîÄØ£¿Ð»Ð»£¡
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

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

Êý·åÇà820

гæ (³õÈëÎÄ̳)

ÄãºÃ£¬ÎÒÒ²ÔÚ¿´Õâ¸ö£¬ÊǸö³õѧÕß¡£¸ù¾Ý¡°Set weighting coefficients for pairwise energy and force contributions between pairs of atoms¡±Õâ¾ä»°£¬ÎÒÈÏΪspecial_bondsÊÇÕë¶Ôpair atoms¼ÓȨµÄ£¬Ò²¾ÍÊÇÈç¹û¶¼ÉèΪ0µÄ»°£¬ÄÇô1-2¡¢1-3¡¢1-4ÕâÈý¸öÀàÐ͵ÄÔ­×Ó¶ÔÖ®¼äµÄpairwise interactions¾Í²»»áÔÙ¼ÆËãÁË£¬µ«ÊÇÓÉÓÚÎÒÃÇÒ²ÓÃÁËpair_style£¬ËùÒÔÔڽضϰ뾶ÄÚ³ýÁËÕâÈý¸öÀàÐ͵ÄËùÓÐpairwise interactions¶¼»¹Æð×÷Óõ쬲¢ÇÒ£¬Èç¹ûinÎļþÖж¨ÒåÁËangle_styleºÍdihedral_styleµÄ»°£¬ÄÇôÕâЩÃüÁî¶¼»¹»áÆð×÷Óõġ£²»ÖªµÀÎÒ˵µÄ¶Ô²»¶Ô£¬Èç¹ûÓÐÎ󣬻¹ÇëÖ¸Õý¸æÖª£¬´ó¼Ò¹²Í¬½ø²½¡£Áí£¬ÎÒÓиöÒÉÎÊ£¬ÎªÊ²Ã´special_bondsÖ»¶Ô1-2¡¢1-3¡¢1-4ÕâÈý¸öÀàÐ͵Äpairwise interactions¼ÓȨ£¬1-5¼°ÒÔÉϵÄÄØ£¿¿ÉÄÜÎҵĻشðºÍÎÊÌâ¶¼ÓеãÓ×ÖÉ£¬µ«È´ÊÇÊÇÎÒËùÖªºÍÎÒËù»ó°¡ лл£¡
²»ÒªÍü¼Ç½×¼¶Ã¬¶Ü£¡
2Â¥2015-01-22 19:47:43
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

Êý·åÇà820

гæ (³õÈëÎÄ̳)

ºÃÏñÎҵĻظ´ÊÇ´íµÄ
²»ÒªÍü¼Ç½×¼¶Ã¬¶Ü£¡
3Â¥2015-01-22 20:52:27
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ °¢Èý°¢Àﱦ±¦ µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 315·Ö£¬³ÏÇóµ÷¼Á£¬²ÄÁÏÓ뻯¹¤085600 +3 13756423260 2026-03-22 3/150 2026-03-22 20:11 by edmund7
[¿¼ÑÐ] 289²ÄÁÏÓ뻯¹¤£¨085600£©BÇøÇóµ÷¼Á +3 ÕâôÃû×ÖÕ¦Ñù 2026-03-22 4/200 2026-03-22 17:56 by ÔÆÃñ´óÀîÀÏʦ
[¿¼ÑÐ] 291 Çóµ÷¼Á +3 »¯¹¤2026½ì±ÏÒµÉ 2026-03-21 3/150 2026-03-22 14:26 by ColorlessPI
[¿¼ÑÐ] Çóµ÷¼Á +5 Zhangbod 2026-03-21 7/350 2026-03-22 13:13 by Zhangbod
[¿¼ÑÐ] ²ÄÁϹ¤³Ìר˶ 348·ÖÇóµ÷¼Á +3 ¶¬´Ç. 2026-03-17 5/250 2026-03-21 18:47 by ѧԱ8dgXkO
[¿¼ÑÐ] ²ÄÁÏѧ˶333Çóµ÷¼Á +3 ±±µÀÏï 2026-03-18 3/150 2026-03-21 18:17 by ѧԱ8dgXkO
[¿¼ÑÐ] 299Çóµ÷¼Á +6 ¡÷С͸Ã÷* 2026-03-17 6/300 2026-03-21 02:42 by JourneyLucky
[¿¼ÑÐ] 083200ѧ˶321·ÖÒ»Ö¾Ô¸ôßÄÏ´óѧÇóµ÷¼Á +3 innocenceF 2026-03-17 3/150 2026-03-21 02:35 by JourneyLucky
[¿¼ÑÐ] »¯Ñ§Çóµ÷¼Á +4 ÁÙÔó¾³llllll 2026-03-17 5/250 2026-03-21 02:23 by JourneyLucky
[¿¼ÑÐ] Ò»Ö¾Ô¸»ªÄÏʦ´ó 070300£¨»¯Ñ§£©304·ÖÇóµ÷¼Á +3 0703ÎäÜ·»ÛÑ©304 2026-03-18 3/150 2026-03-21 00:48 by JourneyLucky
[¿¼ÑÐ] Ò»Ö¾Ô¸Î人Àí¹¤²ÄÁϹ¤³Ìר˶µ÷¼Á +9 Doleres 2026-03-19 9/450 2026-03-20 22:36 by JourneyLucky
[¿¼ÑÐ] Ò»Ö¾Ô¸ Î÷±±´óѧ £¬070300»¯Ñ§Ñ§Ë¶£¬×Ü·Ö287£¬Ë«·ÇÒ»±¾£¬Çóµ÷¼Á¡£ +4 ³¿»èÏßÓëÐǺ£ 2026-03-19 4/200 2026-03-20 22:15 by JourneyLucky
[¿¼ÑÐ] 085600²ÄÁÏÓ뻯¹¤ +8 °²È«Éϰ¶£¡ 2026-03-16 8/400 2026-03-20 22:13 by luoyongfeng
[¿¼ÑÐ] ²ÄÁÏÓ뻯¹¤×¨Ë¶µ÷¼Á +7 heming3743 2026-03-16 7/350 2026-03-20 19:31 by zhukairuo
[¿¼ÑÐ] 08¹¤Ñ§µ÷¼Á +5 Óû§573181 2026-03-20 5/250 2026-03-20 15:47 by xia_2003
[¿¼ÑÐ] ²ÄÁϹ¤³Ìר˶µ÷¼Á +5 204818@lcx 2026-03-17 6/300 2026-03-18 22:55 by 204818@lcx
[¿¼ÑÐ] ÊÕ¸´ÊÔµ÷¼ÁÉú +4 ÓêºóÇïºÉ 2026-03-18 4/200 2026-03-18 14:16 by elevennnne
[¿¼ÑÐ] 301Çóµ÷¼Á +4 A_JiXing 2026-03-16 4/200 2026-03-17 17:32 by ruiyingmiao
[¿¼ÑÐ] ÓÐûÓеÀÌú/ÍÁľµÄÏëµ÷¼ÁÄÏÁÖ£¬¸ø×Ô¼ºÕÐʦµÜÖС« +3 TqlXswl 2026-03-16 7/350 2026-03-17 15:23 by TqlXswl
[¿¼ÑÐ] [µ¼Ê¦ÍƼö]Î÷ÄϿƼ¼´óѧ¹ú·À/²ÄÁϵ¼Ê¦ÍƼö +3 ¼â½ÇСºÉ 2026-03-16 6/300 2026-03-16 23:21 by ¼â½ÇСºÉ
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û