{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.5799176 1.2118143 -0.133312 ] [ -8.3991902 -5.4114721 10.9632051 ] [ -5.5553782 -3.4153718 -1.2561617 ] [ 3.0832087 -2.0489541 -4.819161 ] [ 11.9866448 -3.6449189 -4.0694286 ] [ 1.3389027 9.3665553 3.5301157 ] [ 5.1257298 3.9423474 -4.2152575 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.214436686636536e-08 1.941540556207066e-09 -2.13589371431808e-10 ] [ -1.345698628296178e-08 -8.67013415416291e-09 1.756499104496963e-08 ] [ -8.900697145072976e-09 -5.472028894382521e-09 -2.012592924265718e-09 ] [ 4.939844936885516e-09 -3.282786383158499e-09 -7.721147149684073e-09 ] [ 1.92047222186176e-08 -5.839803894404982e-09 -6.519943416651333e-09 ] [ 2.145158621139512e-09 1.500687604272886e-08 5.655868889856553e-09 ] [ 8.212324517757493e-09 6.316336887390651e-09 -6.753587072793254e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9278156 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.590611418098069e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2936825 2.9061479 3.7014102 ] [ 2.5301026 -0.188133 5.3141348 ] [ 1.8021852 0.5648373 3.0117733 ] [ 4.1387969 0.8070308 2.2635586 ] [ 4.5577892 1.1766954 4.6621398 ] [ 3.687067 3.4288817 4.1644161 ] [ 4.4174836 3.2679423 1.7481602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2936825e-10 2.9061479e-10 3.7014102e-10 ] [ 2.5301026e-10 -1.88133e-11 5.3141348e-10 ] [ 1.8021852e-10 5.648373e-11 3.0117733e-10 ] [ 4.1387969e-10 8.070308000000001e-11 2.2635586e-10 ] [ 4.557789200000001e-10 1.1766954e-10 4.6621398e-10 ] [ 3.687067e-10 3.4288817e-10 4.1644161e-10 ] [ 4.4174836e-10 3.2679423e-10 1.7481602e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 6.8e-06 2e-06 ] [ -2.9e-06 -1.31e-05 2.6e-06 ] [ 1.09e-05 -7e-07 -1.21e-05 ] [ -1.68e-05 -7e-06 -6e-07 ] [ 7.7e-06 2.17e-05 -6.5e-06 ] [ 1e-06 5.4e-06 3e-06 ] [ 1.2e-06 -1.31e-05 1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-15 1.08948011112e-14 3.204353268e-15 ] [ -4.6463122386e-15 -2.09885139054e-14 4.165659248399999e-15 ] [ 1.74637253106e-14 -1.1215236438e-15 -1.93863372714e-14 ] [ -2.691656745119999e-14 -1.1215236438e-14 -9.613059803999998e-16 ] [ 1.23367600818e-14 3.476723295779999e-14 -1.0414148121e-14 ] [ 1.602176634e-15 8.6517538236e-15 4.806529901999999e-15 ] [ 1.9226119608e-15 -2.09885139054e-14 1.85852489544e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }