{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.0405474 -6.5382727 -15.7914203 ] [ -7.398125 12.1830793 -1.4538378 ] [ -1.4530573 -1.9922576 5.2049536 ] [ 3.4883856 -7.6478725 10.85191 ] [ 9.3302015 -1.9093626 -7.4907168 ] [ 4.0731425 5.9046861 8.6791113 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.288237706271422e-08 -1.047546766035489e-08 -2.530064441388652e-08 ] [ -1.1853102912756e-08 1.951944482381243e-08 -2.329304933595306e-09 ] [ -2.328054434742772e-09 -3.191948549331118e-09 8.339254970268794e-09 ] [ 5.589009852655381e-09 -1.225324251835925e-08 1.738667649302573e-08 ] [ 1.494863071065309e-08 -3.059136118349902e-09 -1.200145132999379e-08 ] [ 6.525893686686865e-09 9.460350022582731e-09 1.39054692141811e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.065416 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.612657419382625e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8134378 1.2305488 -0.1937415 ] [ 0.0875328 3.0172283 1.0537621 ] [ 0.7005075 1.8306508 3.1098578 ] [ 1.4264209 0.0439731 1.8623566 ] [ 3.063198 1.4883508 0.7461318 ] [ 2.3372918 3.2750303 1.9936351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.134378e-11 1.2305488e-10 -1.937415e-11 ] [ 8.75328e-12 3.0172283e-10 1.0537621e-10 ] [ 7.005075e-11 1.8306508e-10 3.1098578e-10 ] [ 1.4264209e-10 4.39731e-12 1.8623566e-10 ] [ 3.063198e-10 1.4883508e-10 7.461318e-11 ] [ 2.3372918e-10 3.2750303e-10 1.9936351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.8e-06 -1.9e-06 -1.2e-06 ] [ 2.7e-06 -5.7e-06 -8e-07 ] [ 4.7e-06 2.3e-06 4.2e-06 ] [ -9.4e-06 -2.3e-06 -2.5e-06 ] [ -1.1e-06 6.8e-06 4e-07 ] [ 2e-07 8e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.48609453824e-15 -3.04413557952e-15 -1.92261194496e-15 ] [ 4.32587687616e-15 -9.13240673856e-15 -1.28174129664e-15 ] [ 7.53023011776e-15 3.68500622784e-15 6.72914180736e-15 ] [ -1.506046023552e-14 -3.68500622784e-15 -4.005441552e-15 ] [ -1.76239428288e-15 1.089480102144e-14 6.408706483200001e-16 ] [ 3.2043532416e-16 1.28174129664e-15 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -18.293256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.930902708150933e-18 } }