{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6709882 -16.3210306 -7.0016048 ] [ -16.2629371 0.1360913 11.0130216 ] [ -8.9624013 7.9708645 -13.8577485 ] [ 14.017674 -6.8215931 -10.5443647 ] [ 9.4580314 -11.0648148 12.8272813 ] [ 7.4892741 14.3346504 -6.0858499 ] [ 2.9313471 11.7658322 13.649265 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.389245457327267e-08 -2.61491736546814e-08 -1.121780751864106e-08 ] [ -2.605609760716095e-08 2.180422991542791e-10 1.764480573188541e-08 ] [ -1.435934982908753e-08 1.277073274946468e-08 -2.220256066362627e-08 ] [ 2.245878956079602e-08 -1.09293969814306e-08 -1.68939346035288e-08 ] [ 1.515343678787229e-08 -1.772778758604183e-08 2.055157020728503e-08 ] [ 1.199913986978296e-08 2.296664173822137e-08 -9.75060642747802e-09 ] [ 4.69653579106988e-09 1.885094127509583e-08 2.186853327410371e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 143.80653 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.304034602843739e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0673896 -3.9383458 0.5946762 ] [ -3.2346695 2.7653023 7.2397874 ] [ -0.7919501 5.6576712 -2.1169333 ] [ 8.8600642 0.4066283 -1.357264 ] [ 6.5360122 -1.4827393 8.1839029 ] [ 7.7977648 10.2284708 0.1928734 ] [ 4.788079 8.2789596 9.5278183 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.73896e-12 -3.9383458e-10 5.946762e-11 ] [ -3.2346695e-10 2.7653023e-10 7.2397874e-10 ] [ -7.919501e-11 5.6576712e-10 -2.1169333e-10 ] [ 8.8600642e-10 4.066283e-11 -1.357264e-10 ] [ 6.536012200000001e-10 -1.4827393e-10 8.1839029e-10 ] [ 7.797764800000001e-10 1.02284708e-09 1.928734e-11 ] [ 4.788079e-10 8.278959600000001e-10 9.5278183e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }