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hplc303

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[ÇóÖú] Lammps ¿ØÖÆwater droplet ÒÆ¶¯

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fix    1  waterdroplet   setforce 0.0 0.0 0.0
velocity waterdroplet   set 2.0 0.0 0.0

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yangwenbin99

Í­³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
3Â¥: Originally posted by hplc303 at 2013-06-27 08:17:30
units           real
atom_style      full
dimension       3
boundary        p p f

pair_style      lj/cut/coul/long 12.0 12.0
pair_modify     mix arithmetic
bond_style      harmonic
angle_st ...

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9Â¥2013-06-28 21:39:51
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zhang_jaj

ľ³æ (ÕýʽдÊÖ)

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jiaoyixiong: ½ð±Ò+1, ¹ÄÀø½»Á÷ 2013-06-27 07:57:15
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2Â¥2013-06-26 19:39:33
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hplc303

½ð³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
2Â¥: Originally posted by zhang_jaj at 2013-06-26 19:39:33
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units           real
atom_style      full
dimension       3
boundary        p p f

pair_style      lj/cut/coul/long 12.0 12.0
pair_modify     mix arithmetic
bond_style      harmonic
angle_style     harmonic
dihedral_style  none
improper_style  none
kspace_style    ewald 0.00001
kspace_modify   slab  3.0

read_data       data.waterpillar

neighbor        2.0 bin
neigh_modify    delay 5

timestep        1.0

group           water    type 2 3
group           pillar   type 1
velocity        pillar   set 0.0 0.0 0.0
velocity        water    set 2.0 0.0 0.0
fix              1  pillar setforce 0.0 0.0 0.0
fix              2  water  setforce 0.0 0.0 0.0
fix              3  water   shake 0.0001 10 10  b 1 a 1
fix              4  all  nvt temp 300.0 300.0 100.0 #iso 1.0 1.0 1000.0

dump            1 all custom 1 dump.waterpillar  id type x y z

restart 100       tmp.restart1  tmp.restart2

run             40000
Çë¶à¶àÖ¸½Ì£¬Ð»Ð»£¡
3Â¥2013-06-27 08:17:30
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

zhang_jaj

ľ³æ (ÕýʽдÊÖ)

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hplc303: ½ð±Ò+5, ¡ïÓаïÖú 2013-06-27 20:41:38
Ó¦¸ÃÊÇÄã¸øÁËwater set forceΪ0µÄÔ­Òò°É
4Â¥2013-06-27 18:17:55
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
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