{ "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" [ [ 0.7872548 2.971705 2.821442 ] [ 1.838331 0.4014098 1.675971 ] [ 2.974058 1.714847 0.8061894 ] [ 1.598524 2.494897 0.1079685 ] [ 2.930835 1.52262 2.533969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.872548000000001e-11 2.971705e-10 2.821442e-10 ] [ 1.838331e-10 4.014098e-11 1.675971e-10 ] [ 2.974058e-10 1.714847e-10 8.061894e-11 ] [ 1.598524e-10 2.494897e-10 1.079685e-11 ] [ 2.930835e-10 1.52262e-10 2.533969e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.685734 -0.07826 -0.1981507 ] [ -28.683239 -31.6754486 -1.2398346 ] [ 33.7200213 9.1003921 -32.3807731 ] [ -18.649963 10.2559099 -8.5653157 ] [ 12.9274467 12.3974066 42.3840742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.098666982887667e-09 -1.25386342343808e-10 -3.174724189351546e-10 ] [ -4.595561493461878e-08 -5.074966320027209e-08 -1.98643400977892e-09 ] [ 5.402542977973802e-08 1.458043546273302e-08 -5.187971762424954e-08 ] [ -2.988053469738503e-08 1.643177906681127e-08 -1.372314856431119e-08 ] [ 2.071205286937811e-08 1.986283501307162e-08 6.790677277749246e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 14.602569300765051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.339589513729757e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9151963 2.6532237 2.5679074 ] [ 1.493025 0.5863051 1.5723334 ] [ 3.4028017 1.6063832 0.618696 ] [ 1.2707187 2.5313764 0.2440011 ] [ 3.0472612 1.7281904 2.942602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.151963e-11 2.6532237e-10 2.5679074e-10 ] [ 1.493025e-10 5.863051e-11 1.5723334e-10 ] [ 3.4028017e-10 1.6063832e-10 6.18696e-11 ] [ 1.2707187e-10 2.5313764e-10 2.440011e-11 ] [ 3.0472612e-10 1.7281904e-10 2.942602e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.86e-05 7.4e-06 2.68e-05 ] [ 1.53e-05 -9.8e-06 -1.42e-05 ] [ -2.7e-06 -3.26e-05 -1.07e-05 ] [ 1.5e-05 1.61e-05 1e-06 ] [ 1.1e-05 1.89e-05 -2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.184401756288e-14 1.185610699392e-14 4.293833343744e-14 ] [ 2.451330229824e-14 -1.570133088384e-14 -2.275090801536e-14 ] [ -4.32587687616e-15 -5.223095783807999e-14 -1.714328984256e-14 ] [ 2.4032649312e-14 2.579504359488e-14 1.6021766208e-15 ] [ 1.76239428288e-14 3.028113813312e-14 -4.646312200320001e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }