{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4785875 -5.6758483 -6.1905237 ] [ -9.6001104 -4.7092841 0.8712436 ] [ 1.9271928 3.6540273 3.6393374 ] [ -7.0491363 9.4165739 -0.5730131 ] [ 0.2985117 -2.2127132 -0.6838102 ] [ 5.8647 0.5002702 -2.3760476 ] [ 7.0802546 -0.9730258 5.3128136 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.36895832430712e-09 -9.093711449467426e-09 -9.918312342648313e-09 ] [ -1.538107243997894e-08 -7.545104885725168e-09 1.395886126941627e-09 ] [ 3.087703247934091e-09 5.854397111824948e-09 5.830861297483059e-09 ] [ -1.129396137669261e-08 1.508701455061548e-08 -9.180681922321326e-10 ] [ 4.782684667752634e-10 -3.545157357575555e-09 -1.095584715504572e-09 ] [ 9.396285228005762e-09 8.015212185229402e-10 -3.806847914627951e-09 ] [ 1.134381838943166e-08 -1.558959188195217e-09 8.512065740588283e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.413208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.988815164672753e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3155892 0.8678968 1.9835376 ] [ 0.6958372 1.3109587 3.8680761 ] [ 2.3579063 2.5778039 5.2743239 ] [ 1.969743 3.3607166 2.8685136 ] [ 4.4938611 0.0716909 2.9798128 ] [ 4.3228907 2.5929044 2.3181937 ] [ 4.5716576 1.8554713 4.7565983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3155892e-10 8.678968e-11 1.9835376e-10 ] [ 6.958372000000001e-11 1.3109587e-10 3.8680761e-10 ] [ 2.3579063e-10 2.5778039e-10 5.2743239e-10 ] [ 1.969743e-10 3.3607166e-10 2.8685136e-10 ] [ 4.4938611e-10 7.16909e-12 2.9798128e-10 ] [ 4.322890700000001e-10 2.5929044e-10 2.3181937e-10 ] [ 4.5716576e-10 1.8554713e-10 4.756598300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 1.93e-05 2.9e-05 ] [ -1.2e-06 -1.02e-05 -1.45e-05 ] [ -3.02e-05 1.93e-05 1.15e-05 ] [ 5.8e-06 -1.76e-05 1.83e-05 ] [ 2.5e-06 -5.1e-06 -2.65e-05 ] [ 2.2e-05 -1.42e-05 -2.68e-05 ] [ 4.9e-06 8.5e-06 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 3.092200878144e-14 4.64631220032e-14 ] [ -1.92261194496e-15 -1.634220153216e-14 -2.32315610016e-14 ] [ -4.838573394816e-14 3.092200878144e-14 1.84250311392e-14 ] [ 9.292624400640001e-15 -2.819830852608e-14 2.931983216064e-14 ] [ 4.005441552e-15 -8.17110076608e-15 -4.24576804512e-14 ] [ 3.52478856576e-14 -2.275090801536e-14 -4.293833343744e-14 ] [ 7.850665441919999e-15 1.36185012768e-14 1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.993828 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.722711391949642e-18 } }