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lammps/examples/USER/pimd/para-h2/H2.data
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H2.data
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para-Hydrogen density=0.023500
180 atoms
1 atom types
0.000000 19.712190 xlo xhi
0.000000 19.712190 ylo yhi
0.000000 19.712190 zlo zhi
Masses
1 0.5
Atoms
1 1 1 0.0 0.000000 0.000000 0.000000
2 2 1 0.0 0.000000 0.000000 3.285365
3 3 1 0.0 0.000000 0.000000 6.570730
4 4 1 0.0 0.000000 0.000000 9.856095
5 5 1 0.0 0.000000 0.000000 13.141460
6 6 1 0.0 0.000000 0.000000 16.426825
7 7 1 0.0 0.000000 3.285365 0.000000
8 8 1 0.0 0.000000 3.285365 3.285365
9 9 1 0.0 0.000000 3.285365 6.570730
10 10 1 0.0 0.000000 3.285365 9.856095
11 11 1 0.0 0.000000 3.285365 13.141460
12 12 1 0.0 0.000000 3.285365 16.426825
13 13 1 0.0 0.000000 6.570730 0.000000
14 14 1 0.0 0.000000 6.570730 3.285365
15 15 1 0.0 0.000000 6.570730 6.570730
16 16 1 0.0 0.000000 6.570730 9.856095
17 17 1 0.0 0.000000 6.570730 13.141460
18 18 1 0.0 0.000000 6.570730 16.426825
19 19 1 0.0 0.000000 9.856095 0.000000
20 20 1 0.0 0.000000 9.856095 3.285365
21 21 1 0.0 0.000000 9.856095 6.570730
22 22 1 0.0 0.000000 9.856095 9.856095
23 23 1 0.0 0.000000 9.856095 13.141460
24 24 1 0.0 0.000000 9.856095 16.426825
25 25 1 0.0 0.000000 13.141460 0.000000
26 26 1 0.0 0.000000 13.141460 3.285365
27 27 1 0.0 0.000000 13.141460 6.570730
28 28 1 0.0 0.000000 13.141460 9.856095
29 29 1 0.0 0.000000 13.141460 13.141460
30 30 1 0.0 0.000000 13.141460 16.426825
31 31 1 0.0 0.000000 16.426825 0.000000
32 32 1 0.0 0.000000 16.426825 3.285365
33 33 1 0.0 0.000000 16.426825 6.570730
34 34 1 0.0 0.000000 16.426825 9.856095
35 35 1 0.0 0.000000 16.426825 13.141460
36 36 1 0.0 0.000000 16.426825 16.426825
37 37 1 0.0 3.942438 0.000000 0.000000
38 38 1 0.0 3.942438 0.000000 3.285365
39 39 1 0.0 3.942438 0.000000 6.570730
40 40 1 0.0 3.942438 0.000000 9.856095
41 41 1 0.0 3.942438 0.000000 13.141460
42 42 1 0.0 3.942438 0.000000 16.426825
43 43 1 0.0 3.942438 3.285365 0.000000
44 44 1 0.0 3.942438 3.285365 3.285365
45 45 1 0.0 3.942438 3.285365 6.570730
46 46 1 0.0 3.942438 3.285365 9.856095
47 47 1 0.0 3.942438 3.285365 13.141460
48 48 1 0.0 3.942438 3.285365 16.426825
49 49 1 0.0 3.942438 6.570730 0.000000
50 50 1 0.0 3.942438 6.570730 3.285365
51 51 1 0.0 3.942438 6.570730 6.570730
52 52 1 0.0 3.942438 6.570730 9.856095
53 53 1 0.0 3.942438 6.570730 13.141460
54 54 1 0.0 3.942438 6.570730 16.426825
55 55 1 0.0 3.942438 9.856095 0.000000
56 56 1 0.0 3.942438 9.856095 3.285365
57 57 1 0.0 3.942438 9.856095 6.570730
58 58 1 0.0 3.942438 9.856095 9.856095
59 59 1 0.0 3.942438 9.856095 13.141460
60 60 1 0.0 3.942438 9.856095 16.426825
61 61 1 0.0 3.942438 13.141460 0.000000
62 62 1 0.0 3.942438 13.141460 3.285365
63 63 1 0.0 3.942438 13.141460 6.570730
64 64 1 0.0 3.942438 13.141460 9.856095
65 65 1 0.0 3.942438 13.141460 13.141460
66 66 1 0.0 3.942438 13.141460 16.426825
67 67 1 0.0 3.942438 16.426825 0.000000
68 68 1 0.0 3.942438 16.426825 3.285365
69 69 1 0.0 3.942438 16.426825 6.570730
70 70 1 0.0 3.942438 16.426825 9.856095
71 71 1 0.0 3.942438 16.426825 13.141460
72 72 1 0.0 3.942438 16.426825 16.426825
73 73 1 0.0 7.884876 0.000000 0.000000
74 74 1 0.0 7.884876 0.000000 3.285365
75 75 1 0.0 7.884876 0.000000 6.570730
76 76 1 0.0 7.884876 0.000000 9.856095
77 77 1 0.0 7.884876 0.000000 13.141460
78 78 1 0.0 7.884876 0.000000 16.426825
79 79 1 0.0 7.884876 3.285365 0.000000
80 80 1 0.0 7.884876 3.285365 3.285365
81 81 1 0.0 7.884876 3.285365 6.570730
82 82 1 0.0 7.884876 3.285365 9.856095
83 83 1 0.0 7.884876 3.285365 13.141460
84 84 1 0.0 7.884876 3.285365 16.426825
85 85 1 0.0 7.884876 6.570730 0.000000
86 86 1 0.0 7.884876 6.570730 3.285365
87 87 1 0.0 7.884876 6.570730 6.570730
88 88 1 0.0 7.884876 6.570730 9.856095
89 89 1 0.0 7.884876 6.570730 13.141460
90 90 1 0.0 7.884876 6.570730 16.426825
91 91 1 0.0 7.884876 9.856095 0.000000
92 92 1 0.0 7.884876 9.856095 3.285365
93 93 1 0.0 7.884876 9.856095 6.570730
94 94 1 0.0 7.884876 9.856095 9.856095
95 95 1 0.0 7.884876 9.856095 13.141460
96 96 1 0.0 7.884876 9.856095 16.426825
97 97 1 0.0 7.884876 13.141460 0.000000
98 98 1 0.0 7.884876 13.141460 3.285365
99 99 1 0.0 7.884876 13.141460 6.570730
100 100 1 0.0 7.884876 13.141460 9.856095
101 101 1 0.0 7.884876 13.141460 13.141460
102 102 1 0.0 7.884876 13.141460 16.426825
103 103 1 0.0 7.884876 16.426825 0.000000
104 104 1 0.0 7.884876 16.426825 3.285365
105 105 1 0.0 7.884876 16.426825 6.570730
106 106 1 0.0 7.884876 16.426825 9.856095
107 107 1 0.0 7.884876 16.426825 13.141460
108 108 1 0.0 7.884876 16.426825 16.426825
109 109 1 0.0 11.827314 0.000000 0.000000
110 110 1 0.0 11.827314 0.000000 3.285365
111 111 1 0.0 11.827314 0.000000 6.570730
112 112 1 0.0 11.827314 0.000000 9.856095
113 113 1 0.0 11.827314 0.000000 13.141460
114 114 1 0.0 11.827314 0.000000 16.426825
115 115 1 0.0 11.827314 3.285365 0.000000
116 116 1 0.0 11.827314 3.285365 3.285365
117 117 1 0.0 11.827314 3.285365 6.570730
118 118 1 0.0 11.827314 3.285365 9.856095
119 119 1 0.0 11.827314 3.285365 13.141460
120 120 1 0.0 11.827314 3.285365 16.426825
121 121 1 0.0 11.827314 6.570730 0.000000
122 122 1 0.0 11.827314 6.570730 3.285365
123 123 1 0.0 11.827314 6.570730 6.570730
124 124 1 0.0 11.827314 6.570730 9.856095
125 125 1 0.0 11.827314 6.570730 13.141460
126 126 1 0.0 11.827314 6.570730 16.426825
127 127 1 0.0 11.827314 9.856095 0.000000
128 128 1 0.0 11.827314 9.856095 3.285365
129 129 1 0.0 11.827314 9.856095 6.570730
130 130 1 0.0 11.827314 9.856095 9.856095
131 131 1 0.0 11.827314 9.856095 13.141460
132 132 1 0.0 11.827314 9.856095 16.426825
133 133 1 0.0 11.827314 13.141460 0.000000
134 134 1 0.0 11.827314 13.141460 3.285365
135 135 1 0.0 11.827314 13.141460 6.570730
136 136 1 0.0 11.827314 13.141460 9.856095
137 137 1 0.0 11.827314 13.141460 13.141460
138 138 1 0.0 11.827314 13.141460 16.426825
139 139 1 0.0 11.827314 16.426825 0.000000
140 140 1 0.0 11.827314 16.426825 3.285365
141 141 1 0.0 11.827314 16.426825 6.570730
142 142 1 0.0 11.827314 16.426825 9.856095
143 143 1 0.0 11.827314 16.426825 13.141460
144 144 1 0.0 11.827314 16.426825 16.426825
145 145 1 0.0 15.769752 0.000000 0.000000
146 146 1 0.0 15.769752 0.000000 3.285365
147 147 1 0.0 15.769752 0.000000 6.570730
148 148 1 0.0 15.769752 0.000000 9.856095
149 149 1 0.0 15.769752 0.000000 13.141460
150 150 1 0.0 15.769752 0.000000 16.426825
151 151 1 0.0 15.769752 3.285365 0.000000
152 152 1 0.0 15.769752 3.285365 3.285365
153 153 1 0.0 15.769752 3.285365 6.570730
154 154 1 0.0 15.769752 3.285365 9.856095
155 155 1 0.0 15.769752 3.285365 13.141460
156 156 1 0.0 15.769752 3.285365 16.426825
157 157 1 0.0 15.769752 6.570730 0.000000
158 158 1 0.0 15.769752 6.570730 3.285365
159 159 1 0.0 15.769752 6.570730 6.570730
160 160 1 0.0 15.769752 6.570730 9.856095
161 161 1 0.0 15.769752 6.570730 13.141460
162 162 1 0.0 15.769752 6.570730 16.426825
163 163 1 0.0 15.769752 9.856095 0.000000
164 164 1 0.0 15.769752 9.856095 3.285365
165 165 1 0.0 15.769752 9.856095 6.570730
166 166 1 0.0 15.769752 9.856095 9.856095
167 167 1 0.0 15.769752 9.856095 13.141460
168 168 1 0.0 15.769752 9.856095 16.426825
169 169 1 0.0 15.769752 13.141460 0.000000
170 170 1 0.0 15.769752 13.141460 3.285365
171 171 1 0.0 15.769752 13.141460 6.570730
172 172 1 0.0 15.769752 13.141460 9.856095
173 173 1 0.0 15.769752 13.141460 13.141460
174 174 1 0.0 15.769752 13.141460 16.426825
175 175 1 0.0 15.769752 16.426825 0.000000
176 176 1 0.0 15.769752 16.426825 3.285365
177 177 1 0.0 15.769752 16.426825 6.570730
178 178 1 0.0 15.769752 16.426825 9.856095
179 179 1 0.0 15.769752 16.426825 13.141460
180 180 1 0.0 15.769752 16.426825 16.426825
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