{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8089267 0.144273 0.3085018 ] [ 0.0391703 1.366973 2.60492 ] [ 1.362051 2.292395 1.899207 ] [ 2.93764 0.2840218 0.2571454 ] [ 1.745173 0.2602682 2.163878 ] [ 2.951376 1.632187 2.170679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.089267000000001e-11 1.44273e-11 3.085018e-11 ] [ 3.91703e-12 1.366973e-10 2.60492e-10 ] [ 1.362051e-10 2.292395e-10 1.899207e-10 ] [ 2.93764e-10 2.840218e-11 2.571454e-11 ] [ 1.745173e-10 2.602682e-11 2.163878e-10 ] [ 2.951376e-10 1.632187e-10 2.170679e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1042743 1.6727504 -2.5894684 ] [ 7.6620545 0.0883057 0.4392083 ] [ -2.0228894 11.9051872 -7.1679499 ] [ 6.5805556 -0.8798272 -8.4637004 ] [ -0.4857717 -16.7963937 10.8791249 ] [ -5.6296745 4.0099775 6.9027855 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.780125570410286e-09 2.680041583313848e-09 -4.148785730780382e-09 ] [ 1.227596458719543e-08 1.414813280233786e-10 7.036892699213126e-10 ] [ -3.241026103144139e-09 1.907421259808741e-08 -1.14843217488457e-08 ] [ 1.054321233419452e-08 -1.409638570183926e-09 -1.356034290633561e-08 ] [ -7.782920607862713e-10 -2.691078929989241e-08 1.743027956954314e-08 ] [ -9.019732866613932e-09 6.424692200434032e-09 1.105948154649724e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.9395739 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.311893198493877e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6182709 0.5173751 0.4309529 ] [ 0.3354345 1.2500295 2.8564704 ] [ 1.1195648 2.9145423 1.0356356 ] [ 3.1301798 0.3116578 0.3244904 ] [ 1.8271755 -0.6811402 2.3288518 ] [ 2.8137114 1.6676533 2.42793 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.182709e-11 5.173751e-11 4.309529000000001e-11 ] [ 3.354345e-11 1.2500295e-10 2.8564704e-10 ] [ 1.1195648e-10 2.9145423e-10 1.0356356e-10 ] [ 3.1301798e-10 3.116578e-11 3.244904e-11 ] [ 1.8271755e-10 -6.811402e-11 2.3288518e-10 ] [ 2.8137114e-10 1.6676533e-10 2.42793e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.61e-05 8.7e-06 4.01e-05 ] [ 2.34e-05 -1.44e-05 -2.24e-05 ] [ 4.6e-06 -1.15e-05 2.9e-06 ] [ -3.32e-05 -2.1e-05 3.4e-05 ] [ 6.5e-06 3.4e-05 -4.79e-05 ] [ -2.74e-05 4.1e-06 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.181680980288e-14 1.393893660096e-14 6.424728249408e-14 ] [ 3.749093292672001e-14 -2.307134333952e-14 -3.588875630592e-14 ] [ 7.370012455680001e-15 -1.84250311392e-14 4.646312200320001e-15 ] [ -5.319226381056e-14 -3.36457090368e-14 5.44740051072e-14 ] [ 1.04141480352e-14 5.44740051072e-14 -7.674426013632e-14 ] [ -4.389963940992e-14 6.568924145279999e-15 -1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.408585 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.269815775060957e-18 } }