mirror of https://github.com/lammps/lammps.git
421 lines
77 KiB
Plaintext
421 lines
77 KiB
Plaintext
atomtypes:
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Mg Al
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mass:Mg:
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24.500000
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mass:Al:
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26.500000
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fingerprintsperelement:Mg:
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5
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fingerprintsperelement:Al:
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5
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fingerprints:Mg_Mg:
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radialscreened_0
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fingerprints:Mg_Mg_Mg:
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bondscreened_0
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fingerprints:Mg_Al:
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radialscreened_0
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fingerprints:Mg_Al_Al:
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bondscreened_0
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fingerprints:Mg_Al_Mg:
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bondscreened_0
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fingerprints:Al_Al:
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radialscreened_0
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fingerprints:Al_Al_Al:
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bondscreened_0
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fingerprints:Al_Mg:
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radialscreened_0
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fingerprints:Al_Al_Mg:
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bondscreened_0
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fingerprints:Al_Mg_Mg:
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bondscreened_0
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fingerprintconstants:Mg_Mg:radialscreened_0:re:
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3.193592
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fingerprintconstants:Mg_Mg:radialscreened_0:rc:
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9.000000
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fingerprintconstants:Mg_Mg:radialscreened_0:alpha:
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5.520000 5.520000 5.520000 5.520000 5.520000
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fingerprintconstants:Mg_Mg:radialscreened_0:dr:
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2.806408
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fingerprintconstants:Mg_Mg:radialscreened_0:o:
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-1
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fingerprintconstants:Mg_Mg:radialscreened_0:n:
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3
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fingerprintconstants:Mg_Mg_Mg:bondscreened_0:re:
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3.193592
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fingerprintconstants:Mg_Mg_Mg:bondscreened_0:rc:
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9.000000
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fingerprintconstants:Mg_Mg_Mg:bondscreened_0:alphak:
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1.000000 2.000000 6.000000 9.000000
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fingerprintconstants:Mg_Mg_Mg:bondscreened_0:dr:
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2.806408
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fingerprintconstants:Mg_Mg_Mg:bondscreened_0:k:
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4
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fingerprintconstants:Mg_Mg_Mg:bondscreened_0:m:
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4
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fingerprintconstants:Mg_Al:radialscreened_0:re:
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3.193592
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fingerprintconstants:Mg_Al:radialscreened_0:rc:
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9.000000
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fingerprintconstants:Mg_Al:radialscreened_0:alpha:
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5.520000 5.520000 5.520000 5.520000 5.520000
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fingerprintconstants:Mg_Al:radialscreened_0:dr:
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2.806408
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fingerprintconstants:Mg_Al:radialscreened_0:o:
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-1
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fingerprintconstants:Mg_Al:radialscreened_0:n:
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3
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fingerprintconstants:Mg_Al_Al:bondscreened_0:re:
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3.193592
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fingerprintconstants:Mg_Al_Al:bondscreened_0:rc:
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9.000000
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fingerprintconstants:Mg_Al_Al:bondscreened_0:alphak:
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1.000000 2.000000 6.000000 9.000000
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fingerprintconstants:Mg_Al_Al:bondscreened_0:dr:
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2.806408
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fingerprintconstants:Mg_Al_Al:bondscreened_0:k:
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4
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fingerprintconstants:Mg_Al_Al:bondscreened_0:m:
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4
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fingerprintconstants:Mg_Al_Mg:bondscreened_0:re:
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3.193592
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fingerprintconstants:Mg_Al_Mg:bondscreened_0:rc:
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9.000000
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fingerprintconstants:Mg_Al_Mg:bondscreened_0:alphak:
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1.000000 2.000000 6.000000 9.000000
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fingerprintconstants:Mg_Al_Mg:bondscreened_0:dr:
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2.806408
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fingerprintconstants:Mg_Al_Mg:bondscreened_0:k:
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4
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fingerprintconstants:Mg_Al_Mg:bondscreened_0:m:
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4
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fingerprintconstants:Al_Al:radialscreened_0:re:
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2.863780
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fingerprintconstants:Al_Al:radialscreened_0:rc:
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9.000000
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fingerprintconstants:Al_Al:radialscreened_0:alpha:
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4.640000 4.640000 4.640000 4.640000 4.640000
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fingerprintconstants:Al_Al:radialscreened_0:dr:
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2.806408
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fingerprintconstants:Al_Al:radialscreened_0:o:
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-1
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fingerprintconstants:Al_Al:radialscreened_0:n:
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3
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fingerprintconstants:Al_Al_Al:bondscreened_0:re:
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2.806408
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fingerprintconstants:Al_Al_Al:bondscreened_0:rc:
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9.000000
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fingerprintconstants:Al_Al_Al:bondscreened_0:alphak:
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1.000000 2.000000 6.000000 9.000000
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fingerprintconstants:Al_Al_Al:bondscreened_0:dr:
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2.806408
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fingerprintconstants:Al_Al_Al:bondscreened_0:k:
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4
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fingerprintconstants:Al_Al_Al:bondscreened_0:m:
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4
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fingerprintconstants:Al_Mg:radialscreened_0:re:
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2.863780
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fingerprintconstants:Al_Mg:radialscreened_0:rc:
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9.000000
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fingerprintconstants:Al_Mg:radialscreened_0:alpha:
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4.640000 4.640000 4.640000 4.640000 4.640000
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fingerprintconstants:Al_Mg:radialscreened_0:dr:
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2.806408
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fingerprintconstants:Al_Mg:radialscreened_0:o:
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-1
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fingerprintconstants:Al_Mg:radialscreened_0:n:
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3
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fingerprintconstants:Al_Al_Mg:bondscreened_0:re:
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2.863780
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fingerprintconstants:Al_Al_Mg:bondscreened_0:rc:
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9.000000
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fingerprintconstants:Al_Al_Mg:bondscreened_0:alphak:
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1.000000 2.000000 6.000000 9.000000
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fingerprintconstants:Al_Al_Mg:bondscreened_0:dr:
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2.806408
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fingerprintconstants:Al_Al_Mg:bondscreened_0:k:
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4
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fingerprintconstants:Al_Al_Mg:bondscreened_0:m:
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4
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fingerprintconstants:Al_Mg_Mg:bondscreened_0:re:
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2.863780
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fingerprintconstants:Al_Mg_Mg:bondscreened_0:rc:
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11.000000
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fingerprintconstants:Al_Mg_Mg:bondscreened_0:alphak:
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1.000000 2.000000 6.000000 9.000000
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fingerprintconstants:Al_Mg_Mg:bondscreened_0:dr:
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2.806408
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fingerprintconstants:Al_Mg_Mg:bondscreened_0:k:
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4
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fingerprintconstants:Al_Mg_Mg:bondscreened_0:m:
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4
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screening:Mg_Mg_Mg:Cmax:
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2.900000
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screening:Mg_Mg_Mg:Cmin:
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0.490000
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screening:Mg_Mg_Al:Cmax:
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2.900000
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screening:Mg_Mg_Al:Cmin:
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0.490000
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screening:Mg_Al_Al:Cmax:
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2.900000
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screening:Mg_Al_Al:Cmin:
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0.490000
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screening:Al_Mg_Mg:Cmax:
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2.900000
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screening:Al_Mg_Mg:Cmin:
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0.490000
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screening:Al_Mg_Al:Cmax:
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2.900000
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screening:Al_Mg_Al:Cmin:
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0.490000
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screening:Al_Al_Al:Cmax:
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2.900000
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screening:Al_Al_Al:Cmin:
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0.490000
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networklayers:Mg:
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4
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networklayers:Al:
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4
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layersize:Mg:0:
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58
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layersize:Mg:1:
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20
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layersize:Mg:2:
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20
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layersize:Mg:3:
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1
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layersize:Al:0:
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58
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layersize:Al:1:
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20
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layersize:Al:2:
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20
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layersize:Al:3:
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1
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weight:Mg:0:
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-1.785709637141698e+00 -2.371331163952699e+00 -3.584666446035055e-01 -3.994433541292258e-01 -3.474264138268926e-01 -8.381743360502992e-01 6.290413047627712e-01 -5.646601130458131e-01 -5.364061550950701e-01 -1.420156935100460e+00 -2.816583819554435e+00 -1.494210880082622e+00 -2.951756069400571e+00 -4.056376487273200e+00 -4.878726596441286e+00 -1.919851021890410e+00 -1.040933359344202e+00 -1.912164145788669e+00 3.582828089435102e+01 -4.267173909417400e+00 -6.073492346374423e+01 -1.607220925670398e-01 -1.719640989485931e-01 -5.649704843356557e-01 1.646854362247616e-01 9.226352576765787e-01 -1.510449197387298e+00 -5.880715677047327e-01 -4.644240538486470e-01 -1.806294357203167e+00 -1.091128419087364e+00 -8.228279168644904e-01 -1.649720523253538e+00 7.072598136485905e-02 -1.073496895419296e-01 3.320321961475337e+00 -2.547682785422520e+00 -1.290055452330559e+00 1.430839408291663e-01 1.999754445059562e+01 -4.972915253338146e+00 6.208169152968830e+00 3.472185560305259e-02 -3.599451946554959e-02 1.046983976380782e-01 -1.694934642255984e-01 -1.294106101219921e+00 -3.274114430854418e-01 -4.747836733460055e-01 8.296459354302431e-02 -5.639484222062460e-01 6.591804413161815e+00 -1.443877461097912e+00 3.870638814650015e+00 9.999345057385436e-01 1.440698787682816e+01 -2.757151858789724e+00 7.584676150455445e+00
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-1.516123250662651e+00 -1.889482637400315e+00 -8.845136034875191e-01 -1.768081476547574e+00 -4.944738947512313e-01 -1.539847337564832e+00 3.579604433064165e-01 -7.328663859063962e-01 -7.577813442716000e-01 9.565861327587108e-02 8.453058400993022e-01 -8.294539765971408e-01 6.148647179847951e-01 -9.768006368808708e-01 4.366809359226592e+00 -1.111644839699821e+00 -1.309930309373545e+00 -1.414575276229275e+00 -3.678183236986850e+01 3.464630282863912e+00 5.865608837071269e+01 8.679084311160959e-01 1.771023159259409e+00 -2.074962144113289e-01 1.236538330236955e+00 -6.947842423978178e-01 5.261597058141348e-01 7.312115571035712e-01 5.872212540509701e-01 2.329576421085782e-01 -4.054636819359206e-01 1.548668586152546e+00 9.234094464501965e-01 1.534166807735957e-01 -9.703966105167389e-01 -1.261822800509360e+01 3.430765282553199e+00 -2.166411434623481e+01 -1.734867333237623e+00 -4.849650293621495e+01 3.609583973481238e+00 -5.898071561915224e+01 1.271431259060009e-01 -1.587574442499559e-01 -9.108624394784862e-02 2.157346586330218e-01 1.371638960931185e+00 3.197845474224496e-01 8.102353388832680e-02 -5.438324250447317e-01 -1.374618240214261e+00 -1.098822687968962e+01 -8.980012911691826e-01 -6.859907883157475e+00 -6.000857886012690e+00 -3.182678105931556e+01 -5.309281873382854e+00 -1.099113141972782e+01
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-1.595948299400713e+00 -9.917357012461063e-01 3.289330499748370e-02 -1.082482821580614e+00 -1.254500180940821e+00 -1.512946254495855e+00 -4.807750350668318e-01 -1.636683797306628e+00 -1.447406382731868e-02 -2.606128047694211e+00 -1.151000304617074e+00 -2.251392163542068e+00 -2.825456228048855e-01 -5.590089894162079e-01 -9.809469334321716e-02 1.523487901335693e-01 1.109775319138070e+00 1.599120510968118e+00 3.806208494958453e+01 -1.824568529302817e+00 -6.026898076177336e+01 -1.645931841175404e+00 -1.142472808402406e+00 1.732520209244453e-01 -9.802189137231041e-01 1.021020494977193e+00 -7.974296633990253e-01 7.987563605865354e-01 -1.325348310611384e+00 -3.306950717367093e-01 -4.197399091732549e-01 -1.923423889030254e-01 -1.087078691840971e+00 6.130016250913731e-02 -3.043680836177625e-01 3.249073856734301e+00 -3.494282750607797e+00 -2.787348580664225e+00 2.532233131252668e-01 2.132700744535062e+01 -3.891945294376054e+00 4.984721944290221e+00 -8.591074010436380e-03 1.389729557632992e+00 5.820152538904340e-01 4.845241737098689e-01 -1.784868565802203e+00 6.828170919600101e-01 -3.186308431534978e-01 3.313210512199288e-01 3.726994961108279e-01 5.937319354054387e+00 -2.176709520995805e+00 3.783167240088523e+00 1.156316375146520e+00 1.327963604026587e+01 -1.813351918146697e+00 7.169806893937777e+00
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9.440812872077139e-02 5.302564997698384e-02 1.117978520676761e-02 8.308306593439836e-01 8.217071183559771e-01 8.554924651718659e-01 1.050313049065129e-01 2.687441622967747e-01 1.586282967066217e-01 2.388443897891485e-01 3.072278974606370e-01 1.143764756485686e+00 -8.102687224829047e-01 1.222516372244420e+00 5.221051147689456e-01 2.889680122542625e+00 1.757581330390175e+00 1.536322075513476e+00 4.017976500975776e+01 4.517217388196067e-01 -6.013656349193640e+01 -2.160735963472632e+00 -1.957673626977379e+00 -1.973886617808031e+00 -1.062492073960987e+00 -8.350366929906329e-01 -6.358123655911271e-01 -4.212662774602451e-01 -4.227809085813911e-02 9.521215462528613e-01 6.663462625985257e-01 -2.835635162897592e+00 -6.247022383796982e-01 -2.010753621924918e+00 4.838781227389280e+00 -3.562077608755666e+01 -1.853468424313148e+00 -1.796001032953733e+01 3.260816235457207e+00 -3.119184983948016e+01 -7.756159437740738e+00 -2.911343715170575e+01 -6.240769891615150e-03 1.326515805100646e+00 -1.742970142857320e-01 -1.387194181470721e+00 1.378184119783719e+00 1.193168529844272e+00 1.424871511862715e+00 1.798008366961889e+00 1.646827279092571e+00 -2.330857210956853e+01 -4.077200954765677e-01 6.646107014423341e+00 -3.612096350250668e-01 -5.819393972062899e+01 -3.326422346935368e+00 8.196409742764731e+00
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8.026134238482531e-01 5.444653317168038e-01 1.052983757751088e+00 8.948419628763481e-01 1.178782508742015e+00 1.142882662283424e+00 4.332640192040950e-01 1.558869923854084e-01 1.033710792843344e+00 -4.183386580274796e-01 -4.103498602527378e-02 1.099023830999154e+00 1.091705166073150e+00 7.028908375690883e-01 1.494923339378697e+00 3.589751401086034e+00 1.854972723745576e+00 2.500715101234206e+00 3.895182908222151e+01 -8.322322107408431e-01 -5.952566729517557e+01 9.096784990985787e-02 1.074428966459908e+00 1.500439946691547e+00 9.403175101184030e-01 8.606965912631491e-01 1.111390624836119e+00 -2.176491305293237e-02 7.029030097192503e-01 5.539637420840762e-01 1.240110821832719e+00 -2.424888348772325e-01 1.307144131895208e+00 4.974679740816207e-01 1.014257597477208e+00 3.198593114835498e+00 -1.645652141349619e+00 -1.013700609843676e+00 2.867207197965427e+00 2.097055581464869e+01 -3.706228798378251e+00 6.265537959610239e+00 -1.832126463267875e-01 -1.036520916459131e+00 3.353741379602614e-01 2.259476240135999e-01 9.300139076017763e-01 -1.615249566522349e+00 -2.167774474441668e-01 -6.476169450903692e-01 1.280583519684650e+00 5.527271292227306e+00 -1.506063099130910e+00 2.848449946786113e+00 2.624350303457668e+00 1.469239715533939e+01 -2.010280388147575e+00 6.291762476210704e+00
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6.495078551193052e-01 2.168574166719645e+00 3.339759130343636e-01 1.119973312080915e+00 2.436885485890690e+00 1.359054452572750e+00 1.443958925175723e-01 1.895568642371617e+00 -5.175259743572410e-01 1.125230448008709e+00 6.831000746675069e-01 1.421760703875003e+00 8.746006899327209e-01 6.238777705632904e-01 6.106764895058953e-01 -9.616007774361685e-01 -1.744995359801435e+00 -1.042597546941120e+00 -3.827922662677923e+01 2.481465058984861e+00 6.071758460012248e+01 4.500417576803731e-01 -7.243147511699479e-01 1.618980874016269e-01 -1.159452824977600e-01 6.036337012610200e-01 -9.611944887221133e-02 9.136321632450725e-01 6.743230971994020e-01 7.437251526369391e-02 9.868885410595589e-01 -3.584919506612915e-01 1.106885256506014e+00 1.259559780097294e+00 -1.255472277829583e+00 -7.310443622500878e+00 1.725841423474411e+00 8.527143411398804e-01 -5.139157040102878e+00 -2.660349676027390e+01 9.676328892527145e-01 -8.730602073559078e+00 3.703174666230394e-01 7.001918359788613e-01 -3.874684682112543e-02 -1.155032963726255e+00 6.455549204231563e-01 -8.236664770470153e-02 2.982460443128121e-01 1.129936952604915e-01 -8.920492080906998e-01 -4.954977239408588e+00 2.277537957874971e+00 -4.244912308318869e+00 -2.993317215817838e+00 -1.019592704515189e+01 2.241378301418246e+00 -6.765114817202972e+00
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weight:Mg:1:
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weight:Mg:2:
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weight:Al:0:
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5.493792578424040e-01 1.276111389980823e+00 2.690460228775156e-01 7.379479318940000e-01 1.011765910960222e+00 4.119241998874386e-01 -1.950395625418125e-01 8.184742776601135e-01 3.351781334859828e-01 9.087186548791135e-01 7.779661965006451e-01 -4.531588881447282e-01 -1.209639396813327e+00 7.591251029587816e-01 2.683542337303467e-01 -1.017999320107711e+00 -9.415834496252479e-01 8.519646469589288e-01 -5.202023713484714e-01 7.704094082554132e-01
|
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-1.075789996389904e+00 -4.742668620429637e-01 -6.558842432828349e-01 -5.552398634751469e-01 -5.696185779971747e-01 3.136947694468237e-01 4.841374135516042e-01 8.056716188911026e-01 7.722656581112528e-01 9.263197670303960e-01 -1.072342748173361e+00 -9.035735090126356e-01 1.776241320626453e-02 1.082897010674743e-01 9.545418104246070e-01 3.110063574022571e-01 -1.372090936474997e+00 2.708112203062142e-01 1.106319129759726e+00 3.741025755982980e-01
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-6.409039990558760e-01 -6.198651489741381e-01 -6.331904628571726e-01 -1.329242917346505e-01 5.790318725619163e-01 9.913916747560542e-01 5.491450539928419e-01 -6.337941257249047e-01 2.585861228021201e-01 -1.862731077016331e-01 -8.461064505579956e-01 -5.494435273784494e-01 6.243812045008411e-01 -3.358848790376691e-01 2.009158109167070e-01 -1.718864655936684e-01 1.132560758877454e+00 -6.617106426593899e-01 9.773970219199652e-01 9.312964775103416e-01
|
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-1.843994615961358e+00 -8.685242556701873e-01 -1.591718024185837e-01 4.888807482463509e-03 -1.070203735766175e+00 6.888707518369401e-01 -6.090931428471550e-01 -1.688614196571312e-01 6.046823102487794e-01 -1.225711621316313e+00 -1.389635446519708e+00 -1.666295893478473e-01 1.064404887100253e+00 -6.943730552465772e-01 1.005143978833875e+00 -4.030757473193848e-01 -4.579186879684553e-01 -6.693610069642342e-01 1.874033060523140e-01 -1.675468517588950e+00
|
|
9.974773291876159e-01 6.079038839500417e-01 3.354138341742603e-01 4.534383666967883e-01 1.142121450290879e+00 9.506518940548244e-01 -7.937585013752509e-01 2.145969365704544e-01 2.063501761923578e-02 1.046495191966576e+00 1.176684304926423e-02 -9.053501888503190e-01 -8.173854035386219e-01 -3.812881016073097e-01 -2.883602575786728e-01 -2.693722239240173e-01 2.329230716958027e-01 -6.287294763863015e-01 2.933574715474763e-01 2.754718857927090e+00
|
|
6.938712353031129e-01 1.541391753631175e+00 7.800725297706444e-02 8.237590631135955e-01 2.450164106829603e-01 -1.618697204822798e-01 2.448936949570442e-01 2.977876988087732e-01 1.381535517974605e-01 7.295500311767378e-01 -9.318240689058703e-01 6.010699689551772e-01 2.444414187224716e-01 7.648519621659626e-01 -1.521806211939662e+00 8.817103971114530e-01 -8.697317649087198e-01 9.805969401410045e-01 1.413144763674782e-01 2.083462937622262e+00
|
|
-2.001631417145785e+00 -1.131740971203729e+00 3.337428842571128e-01 -1.148773616825357e+00 -2.657801677992105e-01 -9.297218107434237e-01 -1.642509227315621e-01 1.839234557264083e-01 4.578258956641898e-01 8.472636403872399e-01 -6.717043082137639e-01 -7.156993567553329e-01 1.227956228974581e+00 1.007246618936000e+00 -6.465898938940587e-01 -6.883062796636823e-01 -4.801681015082787e-01 1.066222273514804e-01 3.912414328316632e-01 -1.507990196864420e+00
|
|
-3.839485105342400e-01 -2.141760786738760e+00 7.178170412603320e-01 -2.487398992673547e-01 -5.091871900188701e-01 1.160059778163378e+00 5.064094465485605e-01 7.195495134509805e-02 -5.515994093763954e-01 4.530579552235158e-01 -7.962174291298818e-02 1.220849329739568e-01 -6.531636724287639e-02 5.131285809216268e-01 4.724402419358615e-01 4.515428357467800e-01 -6.241927379327035e-01 4.669693849972243e-01 -5.826818481586439e-01 -1.795757569402424e+00
|
|
weight:Al:2:
|
|
5.135392247082138e-01 -2.557695069587775e-01 -8.759929196994461e-01 -2.592453838725610e-01 -1.189048019572937e+00 2.054550280939581e-01 -7.741415829524717e-01 -1.371240136666099e+00 -1.785581851632136e-01 -5.539664106776194e-01 5.665810200297841e-01 -9.271401805759163e-01 3.229073776050251e-01 1.607505356609535e-01 1.016297936419758e+00 7.113887799356671e-01 -2.767419575935879e-01 -4.198504961044903e-01 1.449509742812711e-01 8.600172384690399e-01
|
|
bias:Mg:0:
|
|
3.731289176409835e+00
|
|
-6.362098051399459e+00
|
|
1.931308809836757e+00
|
|
4.963552044050653e+00
|
|
7.754597633826141e+00
|
|
-3.935935745945748e+00
|
|
-3.988156363681842e+00
|
|
6.752189616521796e+00
|
|
-6.854078701817841e+00
|
|
-3.910885559291621e+00
|
|
8.376344056426712e+00
|
|
1.744418830889844e+00
|
|
5.714182595832976e+00
|
|
6.711849773350551e+00
|
|
-7.721580893085197e+00
|
|
2.393372301200320e+00
|
|
6.167392386379966e+00
|
|
4.153464665687600e+00
|
|
6.333580200641886e+00
|
|
-7.063026995147228e+00
|
|
bias:Mg:1:
|
|
-4.816344573335819e+00
|
|
6.175739957282312e+00
|
|
-3.333139776313989e+00
|
|
-6.802371768156505e+00
|
|
7.422561929694263e+00
|
|
-6.449006822627947e+00
|
|
3.837530092748229e-01
|
|
6.887001449220396e+00
|
|
4.708194954780337e+00
|
|
3.647072225857475e+00
|
|
-6.558555872688774e+00
|
|
-6.660753612846411e+00
|
|
-4.281579495927591e+00
|
|
1.441333632084118e+00
|
|
7.213758051059082e+00
|
|
7.269571344201147e+00
|
|
-6.193060501741222e+00
|
|
6.468596568525814e+00
|
|
4.297019366432399e+00
|
|
-5.109585902756677e+00
|
|
bias:Mg:2:
|
|
-6.973210524091122e+00
|
|
bias:Al:0:
|
|
1.385605881456594e+00
|
|
1.456168048192331e+00
|
|
1.570435419151431e+00
|
|
1.826540771735247e+00
|
|
1.207119457375240e+00
|
|
7.898089296852779e-01
|
|
-1.620004360537007e+00
|
|
1.670224097808616e+00
|
|
3.825092544050332e-01
|
|
1.246171711447400e+00
|
|
6.204763361450589e-01
|
|
5.843024597969713e-01
|
|
8.834918153160423e-01
|
|
1.705474401272730e+00
|
|
-3.416385643555942e+00
|
|
-3.894018054421750e-01
|
|
3.106839779186236e+00
|
|
1.195701572346602e+00
|
|
-8.559051661995589e-01
|
|
1.110081737815194e+00
|
|
bias:Al:1:
|
|
-5.450983710225460e-01
|
|
2.407396020581909e-01
|
|
1.534086726090900e+00
|
|
3.980765207282594e-02
|
|
7.579902523143215e-01
|
|
-2.703133069081817e-01
|
|
1.874269420264722e+00
|
|
2.204400449046542e+00
|
|
8.926548043650204e-01
|
|
1.295723133572349e+00
|
|
-1.498599549429615e+00
|
|
1.962828654094330e+00
|
|
-1.278215062724843e+00
|
|
-1.442692553389844e+00
|
|
8.849366870775945e-01
|
|
-2.059145588034654e+00
|
|
1.499819766671037e+00
|
|
2.637210411767147e-01
|
|
-8.586061133801967e-01
|
|
-6.970775827470471e-01
|
|
bias:Al:2:
|
|
-3.067090914266515e-01
|
|
activationfunctions:Mg:0:
|
|
sigI
|
|
activationfunctions:Mg:1:
|
|
sigI
|
|
activationfunctions:Mg:2:
|
|
linear
|
|
activationfunctions:Al:0:
|
|
sigI
|
|
activationfunctions:Al:1:
|
|
sigI
|
|
activationfunctions:Al:2:
|
|
linear
|
|
calibrationparameters:algorithm:
|
|
LM_ch
|
|
calibrationparameters:dumpdirectory:
|
|
.
|
|
calibrationparameters:doforces:
|
|
0
|
|
calibrationparameters:normalizeinput:
|
|
0
|
|
calibrationparameters:tolerance:
|
|
1.0000000000e-07
|
|
calibrationparameters:regularizer:
|
|
1.0000000000e-04
|
|
calibrationparameters:logfile:
|
|
MgAl1.logon.log
|
|
calibrationparameters:potentialoutputfile:
|
|
MgAl1.nnl_output.nn
|
|
calibrationparameters:potentialoutputfreq:
|
|
100
|
|
calibrationparameters:maxepochs:
|
|
10000000
|
|
calibrationparameters:dimsreserved:Mg:0:
|
|
0
|
|
calibrationparameters:dimsreserved:Mg:1:
|
|
0
|
|
calibrationparameters:dimsreserved:Mg:2:
|
|
0
|
|
calibrationparameters:dimsreserved:Mg:3:
|
|
0
|
|
calibrationparameters:dimsreserved:Al:0:
|
|
0
|
|
calibrationparameters:dimsreserved:Al:1:
|
|
0
|
|
calibrationparameters:dimsreserved:Al:2:
|
|
0
|
|
calibrationparameters:dimsreserved:Al:3:
|
|
0
|
|
calibrationparameters:validation:
|
|
0.100000
|