{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.3682815 -3.3309424 -0.2224772 ] [ -3.4678415 5.4322344 -2.052834 ] [ -5.3956748 -1.8977478 0.0690556 ] [ 1.0340502 -1.2764417 -3.0276899 ] [ 1.3426408 0.8926061 5.0965542 ] [ -0.9943324 -2.0693522 1.2694313 ] [ 4.1128762 2.2496435 -1.13204 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.396581871573155e-09 -5.336758038511442e-09 -3.564477685010458e-10 ] [ -5.556094575940003e-09 8.703398954385514e-09 -3.289002641183347e-09 ] [ -8.644824017999716e-09 -3.040527157334634e-09 1.106392678553165e-10 ] [ 1.656731055173564e-09 -2.045085049554207e-09 -4.850893972812291e-09 ] [ 2.151147699892209e-09 1.430112625003467e-09 8.165579985880047e-09 ] [ -1.593096124583954e-09 -3.315467715041046e-09 2.033853150571751e-09 ] [ 6.589554091884744e-09 3.604326220834685e-09 -1.813728021810432e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.610493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.622600326936206e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5609215 1.7644506 3.2720845 ] [ 1.6590377 5.4540453 2.2276103 ] [ 0.7220928 3.3285065 2.9565539 ] [ 2.6048164 3.2961784 1.2166593 ] [ 2.8565095 4.1734212 4.0981654 ] [ 4.6343283 2.9233545 2.7381734 ] [ 4.0769314 5.2036466 2.0926432 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5609215e-10 1.7644506e-10 3.2720845e-10 ] [ 1.6590377e-10 5.4540453e-10 2.2276103e-10 ] [ 7.220928e-11 3.3285065e-10 2.9565539e-10 ] [ 2.6048164e-10 3.2961784e-10 1.2166593e-10 ] [ 2.8565095e-10 4.1734212e-10 4.0981654e-10 ] [ 4.6343283e-10 2.9233545e-10 2.7381734e-10 ] [ 4.0769314e-10 5.2036466e-10 2.0926432e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.85e-05 -2.18e-05 3.13e-05 ] [ -1.14e-05 -2.17e-05 7.6e-06 ] [ -1.11e-05 1.83e-05 -4.15e-05 ] [ -1.08e-05 2.14e-05 1.59e-05 ] [ -1.11e-05 2.31e-05 1.9e-05 ] [ 1.49e-05 -2.16e-05 -3.45e-05 ] [ 1.1e-05 2.2e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.96402674848e-14 -3.492745033344e-14 5.014812823104e-14 ] [ -1.826481347712e-14 -3.476723267136e-14 1.217654231808e-14 ] [ -1.778416049088e-14 2.931983216064e-14 -6.64903297632e-14 ] [ -1.730350750464e-14 3.428657968511999e-14 2.547460827072e-14 ] [ -1.778416049088e-14 3.701027994048e-14 3.04413557952e-14 ] [ 2.387243164992e-14 -3.460701500928e-14 -5.52750934176e-14 ] [ 1.76239428288e-14 3.52478856576e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }