{ "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" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.5557958 -20.4510104 -55.6594873 ] [ -27.0549124 -40.5155246 50.1711619 ] [ 5.8221017 11.3250914 -75.948914 ] [ 108.311173 5.6454839 55.5499822 ] [ -57.5225665 43.9959597 25.8872571 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.735360503989883e-08 -3.276613073461766e-08 -8.917632927777451e-08 ] [ -4.334674812507202e-08 -6.491302629356728e-08 8.03830626345517e-08 ] [ 9.328035227659936e-09 1.814479666950314e-08 -1.216835743859498e-07 ] [ 1.735336291520242e-07 9.045062317682806e-09 8.900088276669616e-08 ] [ -9.216131121471329e-08 7.048929804099899e-08 4.147595810225881e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 50.368525 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.069927317918032e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9659658 0.1726761 0.6914804 ] [ -0.6049954 -0.7822227 1.8977003 ] [ 2.4437833 1.8082014 0.645423 ] [ 2.9941753 3.3999768 2.0648166 ] [ 2.5542199 4.2646269 4.0416887 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.659658e-11 1.726761e-11 6.914804000000001e-11 ] [ -6.049954e-11 -7.822227000000001e-11 1.8977003e-10 ] [ 2.4437833e-10 1.8082014e-10 6.45423e-11 ] [ 2.9941753e-10 3.3999768e-10 2.0648166e-10 ] [ 2.5542199e-10 4.2646269e-10 4.0416887e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.4033773 0.3898736 -0.0939965 ] [ -0.1079629 -0.1327915 -0.0162851 ] [ -0.356487 -0.2490418 0.2239068 ] [ -0.0670979 0.0003877 0.1078079 ] [ 0.1281705 -0.0084281 -0.2214331 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.462816794214278e-10 6.246463669871308e-10 -1.505989947370272e-10 ] [ -1.729756342937683e-10 -2.127554367409632e-10 -2.609160648739008e-11 ] [ -5.711551370191295e-10 -3.990089495619495e-10 3.587382401981414e-10 ] [ -1.075026866847763e-10 6.211638758841599e-13 1.727272969175443e-10 ] [ 2.053517785762464e-10 -1.350330477776448e-11 -3.547749358912685e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.986111 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.760169019771371e-18 } }