{ "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" [ [ -19.3958496 -22.7107971 -66.2028616 ] [ -33.3552317 -40.9197427 60.2287687 ] [ 11.8852323 13.7801558 -85.4361666 ] [ 107.8462222 -0.7623145 50.2064487 ] [ -66.9803732 50.6126985 41.2038108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.107557676967303e-08 -3.638670815335244e-08 -1.060686770855781e-07 ] [ -5.344097241110704e-08 -6.556065508309148e-08 9.649712511071082e-08 ] [ 1.904224132383701e-08 2.207824345374152e-08 -1.368838286972938e-07 ] [ 1.727886958504419e-07 -1.221362469596842e-09 8.043959832053456e-08 ] [ -1.073143879934989e-07 8.109048225229923e-08 6.601578235162654e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 90.180652 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.444853322829008e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.8613745 0.4988927 0.554554 ] [ 0.0967235 0.8998815 2.7423912 ] [ 2.7443682 1.8582197 0.1821466 ] [ 3.1434567 3.099341 2.1398188 ] [ 1.5072261 2.5069237 3.7221984 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.613745000000001e-11 4.988927000000001e-11 5.54554e-11 ] [ 9.67235e-12 8.998815000000001e-11 2.7423912e-10 ] [ 2.7443682e-10 1.8582197e-10 1.821466e-11 ] [ 3.143456700000001e-10 3.099341e-10 2.1398188e-10 ] [ 1.5072261e-10 2.506923700000001e-10 3.7221984e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 -1.05e-05 -2.87e-05 ] [ -6.4e-06 -5.9e-06 2.92e-05 ] [ 8.6e-06 2.07e-05 1.32e-05 ] [ -8.2e-06 -2.31e-05 0.0 ] [ 7.6e-06 1.88e-05 -1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 -1.68228545184e-14 -4.598246901696e-14 ] [ -1.025393037312e-14 -9.45284206272e-15 4.678355732736e-14 ] [ 1.377871893888e-14 3.316505605055999e-14 2.114873139456e-14 ] [ -1.313784829056e-14 -3.701027994048e-14 0.0 ] [ 1.217654231808e-14 3.012092047104e-14 -2.194981970496e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }