{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.290804000000001e-11 -2.13344e-11 1.3133406e-10 ] [ -3.564175e-11 1.8471668e-10 1.107442e-10 ] [ 1.0200242e-10 2.8044845e-10 2.8056546e-10 ] [ 2.2107157e-10 7.464167000000001e-11 3.0051928e-10 ] [ 2.0847242e-10 1.8415797e-10 8.057181e-11 ] ] "source-value" [ [ 0.8290804 -0.213344 1.3133406 ] [ -0.3564175 1.8471668 1.107442 ] [ 1.0200242 2.8044845 2.8056546 ] [ 2.2107157 0.7464167 3.0051928 ] [ 2.0847242 1.8415797 0.8057181 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.109507309904e-12 -4.14274808840256e-12 -3.336532812816e-12 ] [ -1.8857618826816e-13 5.936064380064e-13 5.3304416174016e-12 ] [ 6.727539630739201e-13 -6.2901454132608e-13 -5.64623062936128e-12 ] [ -1.53921107960256e-12 1.50780841783488e-12 1.20035072430336e-12 ] [ 2.1645406147008e-12 2.67034777388736e-12 2.45181088281024e-12 ] ] "source-value" [ [ -0.0006925 -0.0025857 -0.0020825 ] [ -0.0001177 0.0003705 0.003327 ] [ 0.0004199 -0.0003926 -0.0035241 ] [ -0.0009607 0.0009411 0.0007492 ] [ 0.001351 0.0016667 0.0015303 ] ] } "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" -2.609452244883994e-18 "source-value" -16.28692 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.823756806030887e-09 -2.504771055315511e-08 -5.005747227130528e-09 ] [ -2.288096854777733e-08 8.347110762675901e-09 -1.35093635688737e-08 ] [ -7.039372708404463e-09 2.781189797194039e-08 1.74228755909431e-08 ] [ 2.037685765331666e-08 -1.70534690974977e-08 1.742285187872911e-08 ] [ 1.336724040889603e-08 5.942170916036518e-09 -1.633061667366798e-08 ] ] "source-value" [ [ -2.3866013 -15.6335514 -3.1243417 ] [ -14.2811774 5.2098568 -8.4318816 ] [ -4.3936309 17.3588215 10.8745037 ] [ 12.7182343 -10.6439383 10.8744889 ] [ 8.3431753 3.7088114 -10.1927693 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.251474113465247e-19 "source-value" -0.78110871 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] "source-value" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] } "instance-id" 1 }