{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.468554 0.0062453 1.779472 ] [ 0.0137549 1.819656 0.3703857 ] [ 0.6368997 2.724291 2.946976 ] [ 2.361208 0.5254432 0.0878272 ] [ 1.952332 1.317185 1.267695 ] [ 2.764287 2.133831 2.76552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.685540000000001e-11 6.2453e-13 1.779472e-10 ] [ 1.37549e-12 1.819656e-10 3.703857e-11 ] [ 6.368997e-11 2.724291e-10 2.946976e-10 ] [ 2.361208e-10 5.254432e-11 8.782719999999999e-12 ] [ 1.952332e-10 1.317185e-10 1.267695e-10 ] [ 2.764287e-10 2.133831e-10 2.76552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.9848482 -4.7094391 3.5320594 ] [ -4.2561345 2.4198679 -0.8541451 ] [ -2.4110476 0.510438 0.2151103 ] [ 21.915296 -37.6756493 -57.0196315 ] [ -16.3118689 33.9138311 43.5476413 ] [ 7.0486032 5.5409515 10.5789656 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.588783865076964e-09 -7.545353223101393e-09 5.658982993956876e-09 ] [ -6.819079190880297e-09 3.877055774804392e-09 -1.368491309990878e-09 ] [ -3.86292409635595e-09 8.178118299679103e-10 3.446446935532743e-10 ] [ 3.511217488911176e-08 -6.03630444819199e-08 -9.135552051593123e-08 ] [ -2.613449499313461e-08 5.433594731017995e-08 6.977101278184452e-08 ] [ 1.129310725633607e-08 8.877582950286693e-09 1.694937135656745e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.5990599 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.970682870238786e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0827614 0.1450276 1.0783655 ] [ -0.9639336 1.9792157 1.9100185 ] [ 0.6112546 3.3564411 2.787321 ] [ 3.4933767 0.2857776 -0.5004956 ] [ 2.3321837 0.3781892 1.4390108 ] [ 2.6413928 2.3820003 2.5036556 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.27614e-12 1.450276e-11 1.0783655e-10 ] [ -9.639336e-11 1.9792157e-10 1.9100185e-10 ] [ 6.112546e-11 3.3564411e-10 2.787321e-10 ] [ 3.4933767e-10 2.857776e-11 -5.004956000000001e-11 ] [ 2.3321837e-10 3.781892e-11 1.4390108e-10 ] [ 2.6413928e-10 2.3820003e-10 2.5036556e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.23e-05 1.66e-05 -3.8e-06 ] [ 2.9e-06 -2.76e-05 -2.1e-05 ] [ 2.29e-05 -1.99e-05 5.57e-05 ] [ 2.26e-05 -2.79e-05 1.77e-05 ] [ -2.9e-05 4.67e-05 6.5e-06 ] [ -7.1e-06 1.21e-05 -5.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.970677243584e-14 2.659613190528e-14 -6.08827115904e-15 ] [ 4.646312200320001e-15 -4.422007473408001e-14 -3.36457090368e-14 ] [ 3.668984461632e-14 -3.188331475392e-14 8.924123777856e-14 ] [ 3.620919163008e-14 -4.470072772032e-14 2.835852618816e-14 ] [ -4.64631220032e-14 7.482164819136e-14 1.04141480352e-14 ] [ -1.137545400768e-14 1.938633711168e-14 -8.827993180608e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.74847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.843618368897018e-18 } }