{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.530941e-10 1.3388088e-10 1.3391663e-10 ] [ 1.3104652e-10 2.3873044e-10 3.5861016e-10 ] [ 1.4380835e-10 3.8160655e-10 1.5522322e-10 ] [ 3.890174e-10 1.4095937e-10 1.5387959e-10 ] [ 3.6700125e-10 2.4598254e-10 3.7847973e-10 ] [ 3.7972099e-10 3.8876792e-10 1.7500867e-10 ] ] "source-value" [ [ 1.530941 1.3388088 1.3391663 ] [ 1.3104652 2.3873044 3.5861016 ] [ 1.4380835 3.8160655 1.5522322 ] [ 3.890174 1.4095937 1.5387959 ] [ 3.6700125 2.4598254 3.7847973 ] [ 3.7972099 3.8876792 1.7500867 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.9354293579264e-13 -1.34534770848576e-12 2.6884523697024e-12 ] [ 9.456046415961602e-13 3.1386640001472e-13 -1.03516631469888e-12 ] [ -1.59192269042688e-12 1.44852788286528e-12 -3.76511505888e-13 ] [ 7.1745469079424e-13 1.8248791710912e-12 7.6471890110784e-13 ] [ -1.91107627329024e-12 -1.04013306222336e-12 -3.857881085224321e-12 ] [ 1.64639669553408e-12 -1.20195290092416e-12 1.81622741733888e-12 ] ] "source-value" [ [ 0.0001208 -0.0008397 0.001678 ] [ 0.0005902 0.0001959 -0.0006461 ] [ -0.0009936 0.0009041 -0.000235 ] [ 0.0004478 0.001139 0.0004773 ] [ -0.0011928 -0.0006492 -0.0024079 ] [ 0.0010276 -0.0007502 0.0011336 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.2957188255288e-18 "source-value" -14.32875 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.496659010779674e-10 -9.829999245786183e-10 -1.528364664315068e-09 ] [ -2.91151540973328e-09 -1.207896976187328e-10 2.080272212717879e-09 ] [ 5.064542783237011e-10 9.830316476757101e-10 -2.343130436091514e-10 ] [ 1.768641489959823e-09 -2.172600524409397e-09 -3.192090822615045e-09 ] [ 1.794954196820884e-09 2.460345837886904e-09 2.302046942527974e-09 ] [ -9.088688145108231e-10 -1.669871787382042e-10 5.72449375293412e-10 ] ] "source-value" [ [ -0.1558292 -0.6135403 -0.9539302 ] [ -1.817225 -0.075391 1.2984038 ] [ 0.3161039 0.6135601 -0.1462467 ] [ 1.1038992 -1.3560306 -1.9923464 ] [ 1.1203223 1.5356271 1.4368247 ] [ -0.5672713 -0.1042252 0.3572948 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.121214874956451e-18 "source-value" -13.239582 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.413305e-10 1.605976e-10 1.085725e-10 ] [ 1.596802e-10 1.851301e-10 3.402769e-10 ] [ 1.403818e-10 3.874197e-10 1.795071e-10 ] [ 3.61937e-10 1.350758e-10 2.07249e-10 ] [ 3.606514e-10 2.808679e-10 3.770695e-10 ] [ 3.997077e-10 3.808366e-10 1.42443e-10 ] ] "source-value" [ [ 1.413305 1.605976 1.085725 ] [ 1.596802 1.851301 3.402769 ] [ 1.403818 3.874197 1.795071 ] [ 3.61937 1.350758 2.07249 ] [ 3.606514 2.808679 3.770695 ] [ 3.997077 3.808366 1.42443 ] ] } "instance-id" 1 }