{ "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" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2516365 -3.0234059 1.0955813 ] [ -0.9933099 3.6799388 -2.7056091 ] [ -8.926439 2.0265202 1.480682 ] [ 0.0606166 -3.4765534 -2.4778204 ] [ 3.2205503 -9.0317864 5.3594277 ] [ 3.1607805 3.3984892 -3.392056 ] [ 6.7294381 6.4267974 0.6397945 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.209696022561541e-09 -4.844030288077741e-09 1.755314759507344e-09 ] [ -1.591457912100876e-09 5.895911959909999e-09 -4.334863680757769e-09 ] [ -1.430173199062632e-08 3.246843312769007e-09 2.372314102784388e-09 ] [ 9.711850015252439e-11 -5.570052624333255e-09 -3.969905948128534e-09 ] [ 5.15989043928169e-09 -1.447051713335898e-08 8.586749832552362e-09 ] [ 5.064128662302837e-09 5.444979987141352e-09 -5.434672864419504e-09 ] [ 1.078174848376935e-08 1.029686462573195e-08 1.025063798461713e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.382527 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.144117206327412e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1587191 1.0644715 2.2899516 ] [ 2.047228 4.6170796 1.7479899 ] [ 1.5582197 3.132533 3.690386 ] [ 3.6807313 1.1895124 2.137633 ] [ 3.833834 2.3910425 4.2819943 ] [ 4.1607941 3.4161588 1.1943292 ] [ 5.3767117 4.1346442 3.2926681 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1587191e-10 1.0644715e-10 2.2899516e-10 ] [ 2.047228e-10 4.617079600000001e-10 1.7479899e-10 ] [ 1.5582197e-10 3.132533e-10 3.690386e-10 ] [ 3.6807313e-10 1.1895124e-10 2.137633e-10 ] [ 3.833834e-10 2.3910425e-10 4.2819943e-10 ] [ 4.1607941e-10 3.4161588e-10 1.1943292e-10 ] [ 5.376711700000001e-10 4.1346442e-10 3.2926681e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 -4.7e-06 2.6e-06 ] [ 1e-06 6.2e-06 -1.1e-06 ] [ -2e-06 9.5e-06 4.4e-06 ] [ 1.12e-05 1.12e-05 -1.05e-05 ] [ -1.7e-06 1e-07 -2.6e-06 ] [ -3.8e-06 -1.43e-05 9.3e-06 ] [ -9.2e-06 -7.9e-06 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.209794853e-15 -7.530230179799999e-15 4.165659248399999e-15 ] [ 1.602176634e-15 9.9334951308e-15 -1.7623942974e-15 ] [ -3.204353268e-15 1.5220678023e-14 7.0495771896e-15 ] [ 1.79443783008e-14 1.79443783008e-14 -1.6822854657e-14 ] [ -2.7237002778e-15 1.602176634e-16 -4.165659248399999e-15 ] [ -6.088271209199999e-15 -2.29111258662e-14 1.49002426962e-14 ] [ -1.47400250328e-14 -1.26571954086e-14 -3.364570931399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }