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zyx19840227

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[ÇóÖú] lammps tutorial

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2Â¥2011-05-25 22:03:47
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qphll

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Óù½£½­ºþ(½ð±Ò+2): лл 2011-05-26 09:53:09
ÒýÓûØÌû:
Originally posted by zyx19840227 at 2011-05-25 20:29:39:
³õѧlammps£¬ÓÐûÓÐtutorial°¡£¿ÄÄλ´óÏÀ°ï°ïæ°¡

lammps ×Ô´øµÄһЩexampleѧϰһÏÂ, Ó¦¸Ã¾Í×ã¹». ÁíÍâ, ÂÛ̳ÉÏÒ²Óв»Éٵľ­Ñé×ܽá.
Life, Love, Laugh.
3Â¥2011-05-25 22:09:15
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ben_ladeng

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ÎÄÏ׽ܳö¹±Ï×ÎÄÏ׽ܳö¹±Ï×ÎÄÏ׽ܳö¹±Ï×ÓÅÐã°æÖ÷ÓÅÐã°æÖ÷ÓÅÐã°æÖ÷

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zyx19840227(½ð±Ò+20): Ì«ºÃÌ«ÏêϸÁË£¬·Ç³£¸Ðл 2011-05-26 09:07:40
Óù½£½­ºþ(½ð±Ò+2): À­µÇ¹ø£¬ÄãÓÖ׬ÁË¡£¡£¡£¡£ 2011-05-26 09:53:00
Óù½£½­ºþ(Ä£ÄâEPI+1): À­µÇ½ð±ÒÊÕµÃÌ«¶àÁË£¬°å¿é½ð±ÒÊ¡×ÅÓ㬾Ͳ»¸ø½ð±ÒÄãÁË£¬¹þ¹þ¡£¡£¡£ 2011-05-26 13:33:22
ÒýÓûØÌû:
Originally posted by Óù½£½­ºþ at 2011-05-25 22:03:47:
ľÓУ¬Õâ¸öտľÓУ¬Äã¿ÉÒÔÔÚÍøÉÏÕÒÀýÌâ¡£¡£¡£¡£¡£

http://www.docin.com/p-73654079.html
lammps Óû§ÊÖ²á

http://u.115.com/file/aq2l12xk#
Lammps-Manual.pdf

http://u.115.com/file/e609m2yx#
LammpsѧϰָÄÏ.zip

http://u.115.com/file/clw5fj9m#
lammpsʵÀý.zip

http://u.115.com/file/aq2l16br#
LAMMPS_short_manual.pdf

½é¸öÓ¦¸ÃÊǵΰɣ¿

[ Last edited by ben_ladeng on 2011-5-26 at 01:16 ]
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4Â¥2011-05-26 00:45:05
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527751273

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ÒýÓûØÌû:
Originally posted by qphll at 2011-05-25 22:09:15:
lammps ×Ô´øµÄһЩexampleѧϰһÏÂ, Ó¦¸Ã¾Í×ã¹». ÁíÍâ, ÂÛ̳ÉÏÒ²Óв»Éٵľ­Ñé×ܽá.

ÄãºÃ£¬ÇëÎÊΪʲô»á³öÏÖÒÔÏ´íÎó¡°ERROR: Pair_coeff command before simulation box is defined¡±¡£


# 3d contact simulation

processors    2 2 2
#units                lj
#boundary        p p s
#atom_style        atomic
#neighbor        0.3 bin
#neigh_modify        delay 5

# create geometry

#read_data    bent_2.data

#lattice      fcc     1
#region       sample  block     -15 70 -15 70 -35 20
#create_atoms 2   region    sample


#mass        1        1
#mass        2        1
#mass        3        1
#mass        4        1


# lj potentials

pair_style          lj/cut 1.5
pair_coeff          * * 1.0 1.0 1.5
ERROR: Pair_coeff command before simulation box is defined
5Â¥2011-06-02 22:08:16
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

qphll

½ð³æ (ÕýʽдÊÖ)

¡ï ¡ï
Óù½£½­ºþ(½ð±Ò+2): лл 2011-06-03 22:11:15
ÒýÓûØÌû:
Originally posted by 527751273 at 2011-06-02 22:08:16:
ÄãºÃ£¬ÇëÎÊΪʲô»á³öÏÖÒÔÏ´íÎó¡°ERROR: Pair_coeff command before simulation box is defined¡±¡£


# 3d contact simulation

processors    2 2 2
#units                lj
#boundary        p p ...

±¨´íÐÅÏ¢ÒѾ­¸æËßÄãÁË, ERROR: Pair_coeff command before simulation box is defined

ÄãµÃÏȶ¨ÒåÄ£ÄâºÐ×Ó, È»ºóÔÙ¸³ÖµÁ¦³¡ÐÅÏ¢.
Life, Love, Laugh.
6Â¥2011-06-02 23:15:13
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

527751273

Òø³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
Originally posted by qphll at 2011-06-02 23:15:13:
±¨´íÐÅÏ¢ÒѾ­¸æËßÄãÁË, ERROR: Pair_coeff command before simulation box is defined

ÄãµÃÏȶ¨ÒåÄ£ÄâºÐ×Ó, È»ºóÔÙ¸³ÖµÁ¦³¡ÐÅÏ¢.

ллר¼Ò£¬ÄܸæËßÎÒ¾ßÌåÔõÑùÐÞ¸Äô£¿
7Â¥2011-06-03 16:45:36
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