{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.3556083 -1.6004352 2.8097953 ] [ -0.6718668 -0.164644 0.4695409 ] [ 1.8322224 -3.0895956 1.495754 ] [ 0.4953846 0.6873647 1.1133672 ] [ 0.5794504 0.229131 -0.8849127 ] [ -1.492831 1.4232129 -4.3123168 ] [ -1.0772445 -0.2526177 0.8610996 ] [ -3.0207235 2.7675839 -1.5523275 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.376277166822434e-09 -2.564179860545372e-09 4.501788338893722e-09 ] [ -1.07644927925171e-09 -2.637887675549952e-10 7.522874524893907e-10 ] [ 2.935543893386066e-09 -4.950077838046548e-09 2.396462089268084e-09 ] [ 7.936936244243597e-10 1.101279652303206e-09 1.783810898205558e-09 ] [ 9.283818837932083e-10 3.671083313005248e-10 -1.417786439389004e-09 ] [ -2.391778927005485e-09 2.280238434800968e-09 -6.90909315844307e-09 ] [ -1.725935952785386e-09 -4.047381729402682e-10 1.379633647300232e-09 ] [ -4.839732569601149e-09 4.434158220682485e-09 -2.487102828324912e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.834642 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.338077631513775e-18 } }