{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.5100359e-10 2.1489552e-10 1.0116187e-10 ] [ 2.6761082e-10 2.8761274e-10 2.9579522e-10 ] [ 3.8598489e-10 1.8065443e-10 1.1883532e-10 ] ] "source-value" [ [ 1.5100359 2.1489552 1.0116187 ] [ 2.6761082 2.8761274 2.9579522 ] [ 3.8598489 1.8065443 1.1883532 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.88071063994304e-11 1.082318372649024e-11 4.083002922212928e-11 ] [ 3.733071526464e-13 -3.594034639310976e-11 -7.432192930333249e-11 ] [ -4.91804135520768e-11 2.511716266661952e-11 3.34919000812032e-11 ] ] "source-value" [ [ 0.030463 0.0067553 0.0254841 ] [ 0.000233 -0.0224322 -0.0463881 ] [ -0.030696 0.0156769 0.020904 ] ] } "species" { "source-value" [ "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" -1.051403862054169e-18 "source-value" -6.5623468 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.064802215969361e-09 -1.290390326692065e-09 -1.517694969108851e-09 ] [ 3.225929113281666e-09 -1.270856268895947e-09 -1.416459837146982e-09 ] [ -6.290731329251027e-09 2.561246595588012e-09 2.934154806255832e-09 ] ] "source-value" [ [ 1.9128991 -0.8053983 -0.9472707 ] [ 2.0134666 -0.7932061 -0.8840847 ] [ -3.9263657 1.5986044 1.8313554 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.604401422292256e-19 "source-value" -5.370445 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.4175e-10 2.216571e-10 1.116811e-10 ] [ 2.51368e-10 2.916372e-10 2.980078e-10 ] [ 4.114813e-10 1.698684e-10 1.061035e-10 ] ] "source-value" [ [ 1.4175 2.216571 1.116811 ] [ 2.51368 2.916372 2.980078 ] [ 4.114813 1.698684 1.061035 ] ] } "instance-id" 1 }