{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.2732936e-10 1.3457401e-10 3.3191429e-10 ] [ 2.6295085e-10 2.9287762e-10 1.75657e-10 ] [ 3.1131163e-10 5.197909e-11 1.9069081e-10 ] [ 8.538715e-11 3.7436458e-10 3.2755426e-10 ] [ 3.6952089e-10 1.8652479e-10 3.8836946e-10 ] [ 3.1568371e-10 4.2376448e-10 3.7895959e-10 ] ] "source-value" [ [ 1.2732936 1.3457401 3.3191429 ] [ 2.6295085 2.9287762 1.75657 ] [ 3.1131163 0.5197909 1.9069081 ] [ 0.8538715 3.7436458 3.2755426 ] [ 3.6952089 1.8652479 3.8836946 ] [ 3.1568371 4.2376448 3.7895959 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.6579206701824e-13 -3.636940929216e-13 2.97940764403968e-12 ] [ 1.03356413807808e-12 -3.3533556673344e-13 -3.34999109643072e-12 ] [ -1.51517843029056e-12 -8.571644921279999e-13 -1.8328900541952e-12 ] [ -1.00328299994496e-12 1.49467056954432e-12 -1.88672318865408e-12 ] [ 1.59512704366848e-12 1.37819232921216e-12 7.112062019731201e-13 ] [ -1.07602181852928e-12 -1.31666874697344e-12 3.3789904932672e-12 ] ] "source-value" [ [ 0.0006028 -0.000227 0.0018596 ] [ 0.0006451 -0.0002093 -0.0020909 ] [ -0.0009457 -0.000535 -0.001144 ] [ -0.0006262 0.0009329 -0.0011776 ] [ 0.0009956 0.0008602 0.0004439 ] [ -0.0006716 -0.0008218 0.002109 ] ] } "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" -2.884147829785085e-18 "source-value" -18.001435 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.417503314611388e-18 "source-value" -15.088869 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "instance-id" 1 }