{ "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" [ [ 2.167127 3.726278 2.425808 ] [ 5.703742 2.419847 2.282123 ] [ 3.651151 2.438119 0.811047 ] [ 3.941822 0.8653656 2.619853 ] [ 4.06698 3.157982 3.365965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.167127e-10 3.726278000000001e-10 2.425808e-10 ] [ 5.703742000000001e-10 2.419847e-10 2.282123e-10 ] [ 3.651151e-10 2.438119e-10 8.11047e-11 ] [ 3.941822e-10 8.653656e-11 2.619853e-10 ] [ 4.06698e-10 3.157982e-10 3.365965e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0217582 0.0848594 -1.7852092 ] [ 4.2279671 -1.2013842 -3.0304513 ] [ -0.7739013 0.232063 -0.6792928 ] [ -0.4765534 -1.376535 0.023936 ] [ -1.9557542 2.2609967 5.4710173 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.637037100150691e-09 1.359597467351155e-10 -2.860220443477071e-09 ] [ 6.773950041131576e-09 -1.924829677838511e-09 -4.855318223332968e-09 ] [ -1.239926569666727e-09 3.718059131527104e-10 -1.08834704283777e-09 ] [ -7.635227160427508e-10 -2.205452194712928e-09 3.83496995954688e-11 ] [ -3.133463655271407e-09 3.622516052445952e-09 8.765536010052339e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.239673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.9610117926837e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4634182 3.8104127 2.1913727 ] [ 5.5715821 2.6186236 2.0516625 ] [ 3.5569972 2.290212 0.77467 ] [ 3.9700484 0.8795077 2.6816097 ] [ 3.9687762 3.0088356 3.8054811 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4634182e-10 3.8104127e-10 2.1913727e-10 ] [ 5.5715821e-10 2.6186236e-10 2.0516625e-10 ] [ 3.5569972e-10 2.290212e-10 7.7467e-11 ] [ 3.9700484e-10 8.795077000000001e-11 2.6816097e-10 ] [ 3.9687762e-10 3.0088356e-10 3.805481100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 2.02e-05 1.3e-06 ] [ -7.9e-06 1e-07 1.94e-05 ] [ -1.24e-05 -8.2e-06 -2.8e-05 ] [ 1.64e-05 -2.1e-06 9e-06 ] [ 8.7e-06 -1e-05 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 3.236396774016e-14 2.08282960704e-15 ] [ -1.265719530432e-14 1.6021766208e-16 3.108222644352e-14 ] [ -1.986699009792e-14 -1.313784829056e-14 -4.48609453824e-14 ] [ 2.627569658112e-14 -3.36457090368e-15 1.44195895872e-14 ] [ 1.393893660096e-14 -1.6021766208e-14 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }