{ "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" [ [ -11.9250995 -10.7858602 5.5392908 ] [ -12.4461104 6.9760899 -4.6380371 ] [ 11.6507264 -9.7148519 6.8517966 ] [ 5.7598177 0.5222359 -14.3565728 ] [ 6.9606658 13.0023863 6.6035225 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.910611561961377e-08 -1.728085304765721e-08 8.874922215572527e-09 ] [ -1.994086710277574e-08 1.117692814237901e-08 -7.430954608023032e-09 ] [ 1.866652145341735e-08 -1.556490858871446e-08 1.097778832299693e-08 ] [ 9.228245259010028e-09 8.367141495224467e-10 -2.300176529497319e-08 ] [ 1.115221600996213e-08 2.083211934447022e-08 1.058000936442677e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 79.663725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.276353577208405e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.9754371 -3.307047 4.1809323 ] [ -3.9800037 5.3769474 -0.6748976 ] [ 7.0037681 -2.6862199 4.3542317 ] [ 4.4930625 1.5655198 -4.3794497 ] [ 4.5110127 6.9982588 4.3649917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.9754371e-10 -3.307047e-10 4.1809323e-10 ] [ -3.9800037e-10 5.3769474e-10 -6.748976e-11 ] [ 7.003768100000001e-10 -2.6862199e-10 4.3542317e-10 ] [ 4.4930625e-10 1.5655198e-10 -4.379449700000001e-10 ] [ 4.5110127e-10 6.998258800000001e-10 4.3649917e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }