{ "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" [ [ 7.7390489 6.5188332 -56.2254351 ] [ -20.2375115 -24.9232596 52.2828391 ] [ -2.2749233 5.3539248 -65.149418 ] [ 75.657816 -14.8043347 42.986088 ] [ -60.8844302 27.8548363 26.105926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.239932321480796e-08 1.044432214793485e-08 -9.00830776115277e-08 ] [ -3.242406778847114e-08 -3.993146384524916e-08 8.376634247506811e-08 ] [ -3.644828925373185e-09 8.577933144081316e-09 -1.043808743783267e-07 ] [ 1.212171839759882e-07 -2.371915894283818e-08 6.887130521325143e-08 ] [ -9.754761063716947e-08 4.462836749607117e-08 4.182630430153486e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 39.269454 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.291660111038106e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1458039 0.7968323 0.8525954 ] [ 0.8585071 0.6900385 3.328071 ] [ 2.4827417 2.8552738 0.4083725 ] [ 3.0311292 1.5684063 2.4736048 ] [ 0.8349669 2.9527077 2.2784653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1458039e-10 7.968323e-11 8.525954e-11 ] [ 8.585071e-11 6.900385000000001e-11 3.328071e-10 ] [ 2.4827417e-10 2.8552738e-10 4.083725000000001e-11 ] [ 3.0311292e-10 1.5684063e-10 2.4736048e-10 ] [ 8.349669e-11 2.9527077e-10 2.2784653e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.73e-05 -1.01e-05 -2.21e-05 ] [ -6.2e-06 -4.23e-05 3.33e-05 ] [ 3.66e-05 8.7e-06 -2.25e-05 ] [ 2.86e-05 1.88e-05 1.23e-05 ] [ -2.16e-05 2.49e-05 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.976118795584e-14 -1.618198387008e-14 -3.540810331968e-14 ] [ -9.93349504896e-15 -6.777207105984e-14 5.335248147264001e-14 ] [ 5.863966432128e-14 1.393893660096e-14 -3.604897396800001e-14 ] [ 4.582225135488e-14 3.012092047104e-14 1.970677243584e-14 ] [ -3.460701500928e-14 3.989419785791999e-14 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }