{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.354785e-11 2.471831e-10 2.0610875e-10 ] [ 2.1299953e-10 7.091683e-11 1.6793726e-10 ] [ 2.7962548e-10 2.7321141e-10 1.0531088e-10 ] ] "source-value" [ [ 0.8354785 2.471831 2.0610875 ] [ 2.1299953 0.7091683 1.6793726 ] [ 2.7962548 2.7321141 1.0531088 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.6630593323904e-13 -4.976360584204801e-13 -9.292624400640001e-15 ] [ -3.8083738276416e-13 3.733071526464e-13 1.3362153017472e-13 ] [ 2.1453144952512e-13 1.2432890577408e-13 -1.2432890577408e-13 ] ] "source-value" [ [ 0.0001038 -0.0003106 -5.8e-06 ] [ -0.0002377 0.000233 8.34e-05 ] [ 0.0001339 7.76e-05 -7.76e-05 ] ] } "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" -1.52425194101654e-18 "source-value" -9.5136324 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.963483990414928e-09 -4.338031468658375e-09 -3.30242183168852e-09 ] [ -1.589334758618367e-08 -3.516587952900565e-08 1.301908742919619e-08 ] [ 7.929863435551075e-09 3.950391099766402e-08 -9.71666575772533e-09 ] ] "source-value" [ [ 4.9704158 -2.7075863 -2.0612096 ] [ -9.9198474 -21.9488158 8.1258753 ] [ 4.9494315 24.6564021 -6.0646658 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.107174156221726e-18 "source-value" -6.9104376 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.252086e-11 2.552897e-10 2.103736e-10 ] [ 2.233995e-10 7.543773000000001e-11 1.621303e-10 ] [ 2.802525e-10 2.605839e-10 1.06853e-10 ] ] "source-value" [ [ 0.7252086 2.552897 2.103736 ] [ 2.233995 0.7543773 1.621303 ] [ 2.802525 2.605839 1.06853 ] ] } "instance-id" 1 }