{ "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" [ [ 10.1102705 17.095062 -85.800195 ] [ -33.6700746 -43.2381199 84.5464739 ] [ 3.0800424 7.9043582 -104.7836899 ] [ 110.5646011 -16.645261 66.4776219 ] [ -90.0848393 34.8839606 39.5597891 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.619843902506393e-08 2.738930866752649e-08 -1.374670664890811e-07 ] [ -5.394540634471191e-08 -6.927510483112724e-08 1.354583838536574e-07 ] [ 4.934771924352722e-09 1.266417791046877e-08 -1.678819781989371e-07 ] [ 1.77144018970498e-07 -2.666864802131403e-08 1.065088916145621e-07 ] [ -1.44331823414985e-07 5.589026611422834e-08 6.338176921979868e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 88.973974 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.425520210024671e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.4569635 0.9918442 0.6666444 ] [ 0.6168306 0.339943 3.2318718 ] [ 2.5506661 2.3915982 0.329111 ] [ 3.6466782 2.3658727 2.7434563 ] [ 1.0820106 2.7740005 2.3700255 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.569635e-11 9.918441999999999e-11 6.666444000000001e-11 ] [ 6.168306000000001e-11 3.39943e-11 3.2318718e-10 ] [ 2.5506661e-10 2.3915982e-10 3.29111e-11 ] [ 3.646678200000001e-10 2.3658727e-10 2.7434563e-10 ] [ 1.0820106e-10 2.7740005e-10 2.3700255e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 -6.87e-05 1e-05 ] [ -2.8e-05 3.01e-05 -1.91e-05 ] [ 4.07e-05 4.34e-05 -3.52e-05 ] [ 6e-06 -1.28e-05 -1.83e-05 ] [ -1.33e-05 8.1e-06 6.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.491536090240001e-15 -1.1006953384896e-13 1.6021766208e-14 ] [ -4.48609453824e-14 4.822551628608e-14 -3.060157345728e-14 ] [ 6.520858846656e-14 6.953446534272e-14 -5.639661705216e-14 ] [ 9.6130597248e-15 -2.050786074624e-14 -2.931983216064e-14 ] [ -2.130894905664e-14 1.297763062848e-14 1.0045647412416e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.498488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.842260864814935e-18 } }