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lammps/examples/USER/hdnnp/hdnnp-data/weights.008.data
2021-04-01 00:35:17 +02:00

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# Neural network connection values (weights and biases).
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# Col Name Description
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# 1 connection Neural network connection value.
# 2 t Connection type (a = weight, b = bias).
# 3 index Index enumerating weights.
# 4 l_s Starting point layer (end point layer for biases).
# 5 n_s Starting point neuron in starting layer (end point neuron for biases).
# 6 l_e End point layer.
# 7 n_e End point neuron in end layer.
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# 1 2 3 4 5 6 7
# connection t index l_s n_s l_e n_e
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-4.2252995889643252E-01 a 1 0 1 1 1
-6.0555645962054347E+00 a 2 0 1 1 2
1.4040722027928377E+01 a 3 0 1 1 3
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-3.8202743208058858E+00 a 5 0 1 1 5
-3.3612643261393358E+00 a 6 0 1 1 6
-2.0418101025905258E+00 a 7 0 1 1 7
7.5707237340996727E+00 a 8 0 1 1 8
-5.8098755815926548E+00 a 9 0 1 1 9
-6.0966886893925210E-01 a 10 0 1 1 10
5.8061564015115206E+00 a 11 0 1 1 11
-1.5509339733099867E+00 a 12 0 1 1 12
1.9747395485200818E+00 a 13 0 1 1 13
4.5260782279680539E-01 a 14 0 1 1 14
9.9210415760283279E+00 a 15 0 1 1 15
-6.5078831481547121E+00 a 16 0 1 1 16
-3.4768832871318085E+00 a 17 0 1 1 17
-1.9463994340943838E+00 a 18 0 1 1 18
-3.4186058699290269E+00 a 19 0 1 1 19
1.2263643166698479E+00 a 20 0 1 1 20
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1.8436267358458363E+00 a 22 0 1 1 22
-2.3139530616378448E+00 a 23 0 1 1 23
-1.7228542411478951E+01 a 24 0 1 1 24
2.2888610253215895E+00 a 25 0 1 1 25
8.0819405565169262E+00 a 26 0 2 1 1
8.0066409422078735E+00 a 27 0 2 1 2
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1.0563249167508673E+01 a 33 0 2 1 8
1.0933105521974941E+01 a 34 0 2 1 9
-1.1646509907117448E+01 a 35 0 2 1 10
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7.7790182254249176E+00 a 37 0 2 1 12
1.1567034492555623E+01 a 38 0 2 1 13
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3.1165306119132130E+00 a 40 0 2 1 15
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2.6440539124381655E+00 a 42 0 2 1 17
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4.3903318583813933E+00 a 45 0 2 1 20
3.3748047065442632E-01 a 46 0 2 1 21
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