{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3419769 -2.3426816 0.3700091 ] [ 0.2830458 3.1872632 -0.6286048 ] [ 0.2744136 0.0514041 -0.6158244 ] [ -2.6924265 -2.1195956 0.9713351 ] [ 2.8982631 -1.3666074 -1.6939093 ] [ 1.7647492 0.9844059 -2.1977995 ] [ -0.1860683 1.6058115 3.7947938 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.752260666547755e-09 -3.753389720421734e-09 5.928199343873693e-10 ] [ 4.534893671118372e-10 5.106558625448067e-09 -1.007135922580243e-09 ] [ 4.396590579718223e-10 8.23584479117994e-11 -9.866594643270695e-10 ] [ -4.3137428270624e-09 -3.395966543849209e-09 1.556250401004053e-09 ] [ 4.643529418004405e-09 -2.189546444131491e-09 -2.713941900575296e-09 ] [ 2.827439933110193e-09 1.57719213135174e-09 -3.521263005116883e-09 ] [ -2.981142825881022e-10 2.57279366390849e-09 6.079929957208069e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.267668 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.727891399726951e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8369678 1.0198222 4.0156763 ] [ 2.0631356 5.4963936 1.9539649 ] [ 2.855568 3.2101189 1.0285807 ] [ 1.3434953 3.3023414 3.0143237 ] [ 3.859852 1.863446 2.8075084 ] [ 4.0497136 4.3603647 2.9670564 ] [ 3.0375946 3.1607503 4.8440845 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8369678e-10 1.0198222e-10 4.0156763e-10 ] [ 2.0631356e-10 5.4963936e-10 1.9539649e-10 ] [ 2.855568e-10 3.2101189e-10 1.0285807e-10 ] [ 1.3434953e-10 3.3023414e-10 3.0143237e-10 ] [ 3.859852e-10 1.863446e-10 2.8075084e-10 ] [ 4.0497136e-10 4.3603647e-10 2.9670564e-10 ] [ 3.0375946e-10 3.1607503e-10 4.8440845e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.84e-05 1.97e-05 -5.88e-05 ] [ -1.2e-05 4.6e-05 3.09e-05 ] [ -1.3e-05 -4.65e-05 -3.73e-05 ] [ -0.000137 5e-06 2.1e-05 ] [ 5.74e-05 -6.64e-05 6.58e-05 ] [ 8.34e-05 3.91e-05 -2.74e-05 ] [ -7.2e-06 3.1e-06 5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.550181640559999e-14 3.15628796898e-14 -9.420798607919999e-14 ] [ -1.9226119608e-14 7.370012516399999e-14 4.950725799059999e-14 ] [ -2.082829624199999e-14 -7.450121348099999e-14 -5.97611884482e-14 ] [ -2.19498198858e-13 8.010883169999999e-15 3.364570931399999e-14 ] [ 9.196493879159998e-14 -1.063845284976e-13 1.054232225172e-13 ] [ 1.336215312756e-13 6.26451063894e-14 -4.389963977159999e-14 ] [ -1.15356717648e-14 4.9667475654e-15 9.2926244772e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.75494 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.966178644407196e-18 } }