{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.181937 -2.2902133 -8.8042429 ] [ -3.3248495 -1.903901 1.8331277 ] [ 2.6871011 -1.0548977 3.6405096 ] [ -4.9450738 4.2902676 -0.2512797 ] [ 4.5253052 0.2795562 -2.2001329 ] [ 0.8886729 -5.2761101 4.8542494 ] [ 4.3507811 5.9552984 0.9277688 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.70020169105849e-09 -3.669326205905217e-09 -1.410595213822439e-08 ] [ -5.326996136578569e-09 -3.050385670517741e-09 2.936994343880876e-09 ] [ 4.305210560145963e-09 -1.690132432275692e-09 5.83273936891796e-09 ] [ -7.922881630490616e-09 6.873766445695727e-09 -4.025944606216377e-10 ] [ 7.250338193424668e-09 4.478984078396889e-10 -3.525001495032904e-09 ] [ 1.423810943918536e-09 -8.453260250986751e-09 7.777364900212428e-09 ] [ 6.970719760638506e-09 9.541439866367647e-09 1.486449480867671e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.685158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.153909992435409e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3421386 2.706853 1.408978 ] [ 1.1938029 1.9882562 3.6086612 ] [ 2.7907995 3.3775653 5.024975 ] [ 1.5121758 4.4653852 3.1097065 ] [ 4.8239254 2.3886046 1.4126157 ] [ 3.7324018 1.5240609 3.4914847 ] [ 4.078569 4.2174638 2.9489389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3421386e-10 2.706853e-10 1.408978e-10 ] [ 1.1938029e-10 1.9882562e-10 3.6086612e-10 ] [ 2.7907995e-10 3.3775653e-10 5.024975000000001e-10 ] [ 1.5121758e-10 4.4653852e-10 3.1097065e-10 ] [ 4.823925400000001e-10 2.3886046e-10 1.4126157e-10 ] [ 3.7324018e-10 1.5240609e-10 3.4914847e-10 ] [ 4.078569e-10 4.2174638e-10 2.9489389e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.96e-05 4.19e-05 3.2e-05 ] [ 1.62e-05 5.7e-06 2.75e-05 ] [ -8.7e-06 -1.44e-05 -2.89e-05 ] [ 1.92e-05 -3.92e-05 -4.58e-05 ] [ 2.47e-05 -2.2e-06 -2.82e-05 ] [ -2.3e-05 -2.64e-05 2.33e-05 ] [ 1.2e-06 3.47e-05 2.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.742442797568e-14 6.713120041152e-14 5.12696518656e-14 ] [ 2.595526125696e-14 9.13240673856e-15 4.4059857072e-14 ] [ -1.393893660096e-14 -2.307134333952e-14 -4.630290434112001e-14 ] [ 3.076179111936e-14 -6.280532353535999e-14 -7.337968923264e-14 ] [ 3.957376253376001e-14 -3.52478856576e-15 -4.518138070656001e-14 ] [ -3.68500622784e-14 -4.229746278912e-14 3.733071526464e-14 ] [ 1.92261194496e-15 5.559552874176001e-14 3.236396774016e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }