{ "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" [ [ 4.6010289 -2.0720645 -2.1321239 ] [ -1.9887211 -2.2426902 1.2938566 ] [ 1.8519632 2.7209889 0.332733 ] [ -2.1291035 1.9231989 4.6784901 ] [ -1.5001092 0.2280149 -0.8760527 ] [ 2.8857156 -1.7476275 -0.3375063 ] [ -3.7207739 1.1901796 -2.9593967 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.371660935205142e-09 -3.319813298689642e-09 -3.416039065228917e-09 ] [ -3.186282451711659e-09 -3.593185806137277e-09 2.072986795187778e-09 ] [ 2.967172141621955e-09 4.359504801036309e-09 5.330970335686464e-10 ] [ -3.411199850963453e-09 3.081304314728277e-09 7.495767458864255e-09 ] [ -2.403439888886992e-09 3.653201419740499e-10 -1.403591154528716e-09 ] [ 4.623426068597845e-09 -2.800007922367152e-09 -5.40744703232711e-10 ] [ -5.961336953862837e-09 1.906877929673096e-09 -4.741476204412672e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.17759 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.033894606608788e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.498048 0.9447743 2.181116 ] [ 1.2180657 1.2375617 4.2030368 ] [ 1.9957833 3.1504443 5.4347643 ] [ 2.2463562 3.1771961 3.0669478 ] [ 4.7074716 0.1211373 2.5129451 ] [ 4.4198273 2.4965234 2.2763502 ] [ 3.641933 1.5098054 4.3738958 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.498048e-10 9.447743e-11 2.181116e-10 ] [ 1.2180657e-10 1.2375617e-10 4.2030368e-10 ] [ 1.9957833e-10 3.1504443e-10 5.434764300000001e-10 ] [ 2.2463562e-10 3.1771961e-10 3.0669478e-10 ] [ 4.7074716e-10 1.211373e-11 2.5129451e-10 ] [ 4.4198273e-10 2.4965234e-10 2.2763502e-10 ] [ 3.641933e-10 1.5098054e-10 4.3738958e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.6e-06 -8e-07 -3.21e-05 ] [ -6.84e-05 -4.58e-05 9.67e-05 ] [ -2.8e-06 3.2e-05 9.4e-06 ] [ 4.9e-05 4.6e-06 -8.21e-05 ] [ 1.5e-05 2.04e-05 -5.33e-05 ] [ -1.5e-06 -7.9e-06 7.26e-05 ] [ 1e-07 -2.5e-06 -1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.377871893888e-14 -1.28174129664e-15 -5.142986952768e-14 ] [ -1.0958888086272e-13 -7.337968923264e-14 1.5493047923136e-13 ] [ -4.48609453824e-15 5.12696518656e-14 1.506046023552e-14 ] [ 7.85066544192e-14 7.370012455680001e-15 -1.3153870056768e-13 ] [ 2.4032649312e-14 3.268440306432e-14 -8.539601388864e-14 ] [ -2.4032649312e-15 -1.265719530432e-14 1.1631802267008e-13 ] [ 1.6021766208e-16 -4.005441552e-15 -1.810459581504e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.889965 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.628682649873028e-18 } }