{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.687004e-11 4.499688e-11 3.544338e-11 ] [ 1.2077737e-10 1.978339e-11 2.722857e-10 ] [ 5.439492e-11 2.9928755e-10 3.42107e-11 ] [ 2.8908023e-10 1.95832e-10 -1.083794e-11 ] [ 2.0979036e-10 2.3944503e-10 2.2926828e-10 ] ] "source-value" [ [ 0.8687004 0.4499688 0.3544338 ] [ 1.2077737 0.1978339 2.722857 ] [ 0.5439492 2.9928755 0.342107 ] [ 2.8908023 1.95832 -0.1083794 ] [ 2.0979036 2.3944503 2.2926828 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.28174129664e-12 -7.94407233891264e-12 -2.15620929627264e-12 ] [ 1.474467122356032e-11 2.52430937490144e-11 9.5521770132096e-13 ] [ -4.399897436040959e-12 1.37843265570528e-11 -4.013452435104e-12 ] [ 2.26003034130048e-12 7.6920499564608e-13 4.97652080186688e-12 ] [ -1.132322304984192e-11 -3.185239274513856e-11 2.379232281888e-13 ] ] "source-value" [ [ -0.0008 -0.0049583 -0.0013458 ] [ 0.0092029 0.0157555 0.0005962 ] [ -0.0027462 0.0086035 -0.002505 ] [ 0.0014106 0.0004801 0.0031061 ] [ -0.0070674 -0.0198807 0.0001485 ] ] } "species" { "source-value" [ "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" -1.721419577109013e-18 "source-value" -10.744256 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.327755648971714e-09 -1.19790972811274e-08 -3.43693537369687e-08 ] [ -5.759398292141881e-09 -8.471585786957799e-09 3.349472199488542e-08 ] [ -2.462903905123206e-08 1.573728709178166e-08 -1.085236865537941e-08 ] [ 2.422266153117338e-08 -2.594006461171172e-09 -4.802575706521632e-08 ] [ 7.493531461172266e-09 7.307402597692377e-09 5.975275746267901e-08 ] ] "source-value" [ [ -0.8287199 -7.4767645 -21.4516635 ] [ -3.5947337 -5.287548 20.9057613 ] [ -15.3722372 9.8224421 -6.7735158 ] [ 15.1185963 -1.6190515 -29.9753201 ] [ 4.6770945 4.560922 37.2947381 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.39207874646349e-18 "source-value" 8.6886722 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.137834e-10 6.178187000000001e-11 8.180482000000001e-11 ] [ 8.147489e-11 2.195668e-11 2.521416e-10 ] [ 6.602072e-11 2.742467e-10 5.700191999999999e-11 ] [ 2.747217e-10 2.135327e-10 2.533183e-12 ] [ 2.249122e-10 2.278269e-10 1.668886e-10 ] ] "source-value" [ [ 1.137834 0.6178187 0.8180482 ] [ 0.8147489 0.2195668 2.521416 ] [ 0.6602072 2.742467 0.5700192 ] [ 2.747217 2.135327 0.02533183 ] [ 2.249122 2.278269 1.668886 ] ] } "instance-id" 1 }