{ "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" [ [ 1.198213 1.350624 3.055818 ] [ 2.6169 3.019665 1.923407 ] [ 3.04509 0.4771157 2.258597 ] [ 0.8976629 3.617369 3.27072 ] [ 3.817629 1.77083 3.542328 ] [ 3.146341 4.405242 3.880584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.198213e-10 1.350624e-10 3.055818e-10 ] [ 2.6169e-10 3.019665e-10 1.923407e-10 ] [ 3.04509e-10 4.771157e-11 2.258597e-10 ] [ 8.976629000000001e-11 3.617369e-10 3.27072e-10 ] [ 3.817629e-10 1.77083e-10 3.542328e-10 ] [ 3.146341e-10 4.405242e-10 3.880584e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9705387 -0.6971077 1.471448 ] [ 1.4036763 0.0844146 -2.6438769 ] [ -1.1988354 -7.0028859 -7.7096625 ] [ -1.6121515 2.2336711 1.4718404 ] [ 4.4647346 6.4752412 7.6213161 ] [ -0.0868854 -1.0933333 -0.2110651 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.759327656321625e-09 -1.11688965911966e-09 2.357519584322918e-09 ] [ 2.248937351031047e-09 1.352470985741837e-10 -4.235957757453179e-09 ] [ -1.920746050067416e-09 -1.121986006710997e-08 -1.235224101175848e-08 ] [ -2.582951442487651e-09 3.578735614976619e-09 2.35814827842892e-09 ] [ 7.15329339419684e-09 1.037448006468094e-08 1.221069447514664e-08 ] [ -1.392057565688563e-10 -1.751713052002113e-09 -3.381635686868141e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.088869 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.417503314611388e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2771389 1.3495924 3.3251464 ] [ 2.6319381 2.9292748 1.7569627 ] [ 3.1088232 0.5189058 1.9058267 ] [ 0.8501825 3.7457681 3.2681048 ] [ 3.7022442 1.8636843 3.8804135 ] [ 3.151509 4.2336204 3.795 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2771389e-10 1.3495924e-10 3.3251464e-10 ] [ 2.6319381e-10 2.9292748e-10 1.7569627e-10 ] [ 3.1088232e-10 5.189058e-11 1.9058267e-10 ] [ 8.501824999999999e-11 3.7457681e-10 3.268104800000001e-10 ] [ 3.7022442e-10 1.8636843e-10 3.8804135e-10 ] [ 3.151509e-10 4.233620400000001e-10 3.795e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 -5e-07 3.5e-06 ] [ 1.9e-06 1.5e-06 -3.6e-06 ] [ -2.3e-06 5.1e-06 7e-07 ] [ -6e-07 -7e-07 -2e-06 ] [ 2.5e-06 -1e-06 2.1e-06 ] [ -1.3e-06 -4.3e-06 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-16 -8.010883104e-16 5.6076181728e-15 ] [ 3.04413557952e-15 2.4032649312e-15 -5.76783583488e-15 ] [ -3.68500622784e-15 8.17110076608e-15 1.12152363456e-15 ] [ -9.6130597248e-16 -1.12152363456e-15 -3.2043532416e-15 ] [ 4.005441552e-15 -1.6021766208e-15 3.36457090368e-15 ] [ -2.08282960704e-15 -6.889359469440001e-15 -1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.001462 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.884152155661961e-18 } }