{ "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" [ [ 1.235296 0.1194615 1.060663 ] [ 0.5951279 1.958954 0.23753 ] [ 0.7849876 2.237774 2.150251 ] [ 2.634784 1.158802 0.6457174 ] [ 2.006718 1.111823 2.877883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.235296e-10 1.194615e-11 1.060663e-10 ] [ 5.951279e-11 1.958954e-10 2.3753e-11 ] [ 7.849876000000001e-11 2.237774e-10 2.150251e-10 ] [ 2.634784e-10 1.158802e-10 6.457174e-11 ] [ 2.006718e-10 1.111823e-10 2.877883e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.5242882 -44.6993723 4.1189346 ] [ -13.6081349 10.7218303 -25.9640284 ] [ -30.3881645 36.237396 13.6722107 ] [ 47.9351642 17.0879086 -19.2253523 ] [ 25.5854234 -19.3477625 27.3982355 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.730312429980131e-08 -7.161628926349513e-08 6.599260718724201e-09 ] [ -2.180263558947255e-08 1.717826583884505e-08 -4.159895928426723e-08 ] [ -4.868720671092452e-08 5.805870866987143e-08 2.19052963381916e-08 ] [ 7.680059939544915e-08 2.737784765728726e-08 -3.080240998170351e-08 ] [ 4.099236720474925e-08 -3.099853274229097e-08 4.38968123692726e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 23.046194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.692407322522124e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3900422 -0.097227 0.9426383 ] [ 0.1703517 1.8976903 0.2173875 ] [ 0.4397159 2.8374249 2.4760228 ] [ 3.466321 1.0567238 0.190175 ] [ 1.7904828 0.8922024 3.1458209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3900422e-10 -9.7227e-12 9.426383000000001e-11 ] [ 1.703517e-11 1.8976903e-10 2.173875e-11 ] [ 4.397159e-11 2.8374249e-10 2.4760228e-10 ] [ 3.466321e-10 1.0567238e-10 1.90175e-11 ] [ 1.7904828e-10 8.922024e-11 3.1458209e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.5e-06 -1.07e-05 2.56e-05 ] [ -1.13e-05 1.04e-05 -1.16e-05 ] [ 6.4e-06 -7e-07 -5.1e-06 ] [ 1.51e-05 1.41e-05 -7.5e-06 ] [ -1.7e-06 -1.31e-05 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36185012768e-14 -1.714328984256e-14 4.101572149248001e-14 ] [ -1.810459581504e-14 1.666263685632e-14 -1.858524880128e-14 ] [ 1.025393037312e-14 -1.12152363456e-15 -8.17110076608e-15 ] [ 2.419286697408e-14 2.259069035328e-14 -1.2016324656e-14 ] [ -2.72370025536e-15 -2.098851373248e-14 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.027456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927010881090069e-18 } }