{ "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" [ [ -5.9605503 -8.4763074 -21.3401651 ] [ -12.3863131 -15.807862 20.511015 ] [ 6.786724 5.4933691 -30.9850459 ] [ 31.1075093 -0.8185096 16.1072941 ] [ -19.54737 19.6093099 15.7069019 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.549854337762427e-09 -1.358054154699403e-08 -3.419071360723209e-08 ] [ -1.984506126672877e-08 -2.532698692123273e-08 3.286226870187811e-08 ] [ 1.087353052462226e-08 8.801347541445137e-09 -4.96435161353949e-08 ] [ 4.983972413177858e-08 -1.31139694502036e-09 2.580673003136978e-08 ] [ -3.13183392121273e-08 3.141757787180199e-08 2.51652310093791e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 88.680653 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.420820689538774e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.1469453 -0.3359188 -0.5604397 ] [ -0.142499 -0.7993834 4.9199965 ] [ 3.501296 3.6449781 -1.6058079 ] [ 4.9763807 1.8496756 3.4107992 ] [ 0.1649165 4.5039071 3.1765609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.469453e-11 -3.359188e-11 -5.604397e-11 ] [ -1.42499e-11 -7.993834e-11 4.9199965e-10 ] [ 3.501296e-10 3.6449781e-10 -1.6058079e-10 ] [ 4.9763807e-10 1.8496756e-10 3.4107992e-10 ] [ 1.649165e-11 4.5039071e-10 3.1765609e-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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }