{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2869528 0.4871961 1.041667 ] [ 1.49337 1.111154 0.3370846 ] [ 0.208303 2.963803 0.6319363 ] [ 0.9157171 2.598087 2.560793 ] [ 2.236963 2.266905 1.430037 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.869528e-11 4.871961e-11 1.041667e-10 ] [ 1.49337e-10 1.111154e-10 3.370846e-11 ] [ 2.08303e-11 2.963803e-10 6.319363e-11 ] [ 9.157170999999999e-11 2.598087e-10 2.560793e-10 ] [ 2.236963e-10 2.266905e-10 1.430037e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -30.2171165 -17.9535427 16.3678697 ] [ 29.2042186 -8.8703762 -30.8562838 ] [ -26.672767 19.3186488 -10.1913158 ] [ -11.8132049 3.7012213 18.1309293 ] [ 39.4988698 3.8040488 6.5488006 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.841315760428993e-08 -2.876474637447451e-08 2.622421816564071e-08 ] [ 4.679031626965251e-08 -1.421190936534075e-08 -4.943721650912979e-08 ] [ -4.273448369944576e-08 3.095188745280597e-08 -1.632828790994965e-08 ] [ -1.89268407075e-08 5.930010235266983e-09 2.904895103783771e-08 ] [ 6.328416574158317e-08 6.094758051742295e-09 1.049233521560101e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.210382 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.956318857143715e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0140266 -1.7771096 -0.3440841 ] [ 1.9254075 -0.0005295 0.5814516 ] [ -0.7246919 5.2813265 2.2883779 ] [ 0.967116 3.8976879 2.0350978 ] [ 1.9594476 2.0257699 1.4406747 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0140266e-10 -1.7771096e-10 -3.440841e-11 ] [ 1.9254075e-10 -5.295e-14 5.814516e-11 ] [ -7.246919000000001e-11 5.281326499999999e-10 2.2883779e-10 ] [ 9.67116e-11 3.8976879e-10 2.0350978e-10 ] [ 1.9594476e-10 2.0257699e-10 1.4406747e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0541531 0.0215414 0.0196421 ] [ -0.0322811 -0.0394341 -0.0229361 ] [ -0.0149421 0.0581958 0.0215691 ] [ -0.0246741 0.0605952 0.0207221 ] [ 0.0177442 -0.1008983 -0.0389972 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.676283076384449e-11 3.451312745930112e-11 3.147011340341568e-11 ] [ -5.172002371370688e-11 -6.318039308228928e-11 -3.674768319233088e-11 ] [ -2.393988328565568e-11 9.323995018875264e-11 3.455750775169728e-11 ] [ -3.953226615928128e-11 9.708421277270017e-11 3.320046415387968e-11 ] [ 2.842934239479936e-11 -1.616568973384646e-10 -6.248040211666177e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.148126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.786126684293262e-18 } }