{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7481215 0.3697243 2.264709 ] [ 0.2413431 2.204484 1.035234 ] [ 2.632044 0.6504598 2.339521 ] [ 2.588426 1.874203 0.0457334 ] [ 2.842468 2.848588 2.160611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481215e-11 3.697243e-11 2.264709e-10 ] [ 2.413431e-11 2.204484e-10 1.035234e-10 ] [ 2.632044e-10 6.504598e-11 2.339521e-10 ] [ 2.588426e-10 1.874203e-10 4.57334e-12 ] [ 2.842468e-10 2.848588e-10 2.160611e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.8423633 -2.2196431 0.0388107 ] [ 1.0140696 0.5050729 -0.7123794 ] [ 10.7893716 -0.1184325 0.1324629 ] [ -0.8542363 0.0801349 1.0894992 ] [ -0.1068416 1.7528678 -0.5483934 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.737138099347994e-08 -3.556260281340036e-09 6.218159617688256e-11 ] [ 1.624718604984008e-09 8.092159921796564e-10 -1.141357619819532e-09 ] [ 1.728647893064349e-08 -1.89749782642896e-10 2.122289615033683e-10 ] [ -1.368637428498695e-09 1.283902632901459e-10 1.745570146620303e-09 ] [ -1.711791136488653e-10 2.80840380851313e-09 -8.786230844810228e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.6197373992349497 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.197282013689633e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5409216 0.3317265 2.3080665 ] [ 0.4990965 2.3438065 1.0914462 ] [ 2.8753117 0.5908913 2.1903431 ] [ 2.5849681 1.7458169 0.1438065 ] [ 2.5521047 2.9352179 2.112146 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.409216e-11 3.317265e-11 2.3080665e-10 ] [ 4.990965e-11 2.3438065e-10 1.0914462e-10 ] [ 2.8753117e-10 5.908913e-11 2.1903431e-10 ] [ 2.5849681e-10 1.7458169e-10 1.438065e-11 ] [ 2.5521047e-10 2.9352179e-10 2.112146e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 -3.06e-05 -1.19e-05 ] [ -5.12e-05 3.18e-05 -4.72e-05 ] [ 2.34e-05 -4.21e-05 1.06e-05 ] [ -3.43e-05 -4.05e-05 -3.2e-06 ] [ 4.87e-05 8.14e-05 5.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.146916671872e-14 -4.902660459647999e-14 -1.906590178752e-14 ] [ -8.203144298496001e-14 5.094921654144e-14 -7.562273650176e-14 ] [ 3.749093292672001e-14 -6.745163573568001e-14 1.698307218048e-14 ] [ -5.495465809344e-14 -6.488815314240001e-14 -5.126965186560001e-15 ] [ 7.802600143296e-14 1.3041717693312e-13 8.283253129536002e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.092110399234951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.158460232186793e-19 } }