{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0748528 -0.6537322 7.7761611 ] [ -1.6294792 1.4625526 -4.4918428 ] [ -1.9740939 -0.7632364 -2.8547748 ] [ 2.9471456 2.7324887 -3.4682604 ] [ -4.1296706 -2.7537382 4.5286039 ] [ 3.332831 -1.3071789 2.0058957 ] [ 2.5281199 1.2828445 -3.4957826 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.722104026961418e-09 -1.04739444710415e-09 1.245878351399441e-08 ] [ -2.610713478319888e-09 2.343267582410254e-09 -7.19672551846881e-09 ] [ -3.162847093843893e-09 -1.222839516223557e-09 -4.573853442208996e-09 ] [ 4.721847778413588e-09 4.377929511740185e-09 -5.556765727726456e-09 ] [ -6.616461686925109e-09 -4.411974963843875e-09 7.255623293443702e-09 ] [ 5.339783909277486e-09 -2.094331472783061e-09 3.213799194303251e-09 ] [ 4.050494598359234e-09 2.055343466021866e-09 -5.600861153119439e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.042153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.531542220869658e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4956851 2.2338444 2.1521814 ] [ 2.1646366 2.8755853 4.6121596 ] [ 1.9901965 0.5265406 3.9967673 ] [ 3.7749162 0.0279536 2.4177472 ] [ 5.0523772 2.0688535 2.0572548 ] [ 4.3200307 1.4972441 4.4467757 ] [ 4.0571637 3.8287881 3.4134661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4956851e-10 2.2338444e-10 2.1521814e-10 ] [ 2.1646366e-10 2.8755853e-10 4.6121596e-10 ] [ 1.9901965e-10 5.265406e-11 3.9967673e-10 ] [ 3.7749162e-10 2.79536e-12 2.4177472e-10 ] [ 5.0523772e-10 2.0688535e-10 2.0572548e-10 ] [ 4.3200307e-10 1.4972441e-10 4.4467757e-10 ] [ 4.0571637e-10 3.828788100000001e-10 3.4134661e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.46e-05 -4.4e-06 9e-07 ] [ -2.65e-05 -2.96e-05 -1.06e-05 ] [ -3.82e-05 1.45e-05 2.96e-05 ] [ 1.87e-05 1.08e-05 -4e-06 ] [ 3.37e-05 4.2e-06 -6.27e-05 ] [ 4.5e-06 -2e-06 3.28e-05 ] [ 2.23e-05 6.5e-06 1.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.339177866368e-14 -7.04957713152e-15 1.44195895872e-15 ] [ -4.24576804512e-14 -4.742442797568e-14 -1.698307218048e-14 ] [ -6.120314691456e-14 2.32315610016e-14 4.742442797568e-14 ] [ 2.996070280896e-14 1.730350750464e-14 -6.4087064832e-15 ] [ 5.399335212096e-14 6.72914180736e-15 -1.0045647412416e-13 ] [ 7.2097947936e-15 -3.2043532416e-15 5.255139316223999e-14 ] [ 3.572853864384e-14 1.04141480352e-14 2.24304726912e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }