{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.07828e-12 2.154037e-11 2.3388171e-10 ] [ 9.157482e-11 2.3472801e-10 -1.679755e-11 ] [ 2.439213e-11 2.6977355e-10 2.2125289e-10 ] [ 1.7963796e-10 1.441124e-11 6.151003000000001e-11 ] [ 3.545715e-10 1.0053676e-10 1.9939181e-10 ] [ 2.4500389e-10 2.8083187e-10 3.121371e-10 ] ] "source-value" [ [ -0.0107828 0.2154037 2.3388171 ] [ 0.9157482 2.3472801 -0.1679755 ] [ 0.2439213 2.6977355 2.2125289 ] [ 1.7963796 0.1441124 0.6151003 ] [ 3.545715 1.0053676 1.9939181 ] [ 2.4500389 2.8083187 3.121371 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.72762705020864e-12 2.1332981705952e-12 3.68500622784e-14 ] [ 1.09476728499264e-12 -1.63069536465024e-12 -8.108615877868801e-13 ] [ 9.081137086694401e-13 4.0326785545536e-13 2.71584958991808e-12 ] [ -2.16998801521152e-12 -3.29071056146112e-12 -4.47952561409472e-12 ] [ -1.89569537773056e-12 5.11142407333824e-12 3.38347658780544e-12 ] [ 3.3501513140928e-13 -2.72658417327744e-12 -8.457890381203201e-13 ] ] "source-value" [ [ 0.0010783 0.0013315 2.3e-05 ] [ 0.0006833 -0.0010178 -0.0005061 ] [ 0.0005668 0.0002517 0.0016951 ] [ -0.0013544 -0.0020539 -0.0027959 ] [ -0.0011832 0.0031903 0.0021118 ] [ 0.0002091 -0.0017018 -0.0005279 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.10409770059281e-18 "source-value" -13.132745 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.969427417079593e-08 -4.145855958568056e-08 7.427213365395802e-09 ] [ -1.469901143291479e-08 1.900015070204964e-08 -2.67900370932066e-08 ] [ -5.124758044068953e-08 4.020905856874559e-08 3.833861653869441e-08 ] [ 3.833737276898369e-08 -4.536890138087038e-08 -5.157393548702805e-08 ] [ 4.471141471903372e-08 -2.264253230263455e-08 2.815253305828245e-08 ] [ 4.259207855638282e-08 5.026078415860792e-08 4.445609778079653e-09 ] ] "source-value" [ [ -37.2582357 -25.8763978 4.635702 ] [ -9.1744014 11.8589614 -16.7210261 ] [ -31.9862241 25.0965206 23.9290825 ] [ 23.9283062 -28.3170412 -32.1899189 ] [ 27.9066703 -14.1323572 17.5714292 ] [ 26.5838847 31.3703143 2.7747314 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.993213239208347e-18 "source-value" 31.165186 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.973138000000001e-11 9.928352999999999e-12 1.535424e-10 ] [ 4.571454e-11 2.256303e-10 1.12609e-11 ] [ 1.021874e-10 2.429871e-10 2.604005e-10 ] [ 1.808416e-10 4.621254e-11 9.60442e-11 ] [ 2.7331e-10 1.011411e-10 2.670813e-10 ] [ 2.623171e-10 2.959224e-10 2.230467e-10 ] ] "source-value" [ [ 0.2973138 0.09928353 1.535424 ] [ 0.4571454 2.256303 0.112609 ] [ 1.021874 2.429871 2.604005 ] [ 1.808416 0.4621254 0.960442 ] [ 2.7331 1.011411 2.670813 ] [ 2.623171 2.959224 2.230467 ] ] } "instance-id" 1 }