{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.600247 1.761403 2.21582 ] [ 1.350999 3.710266 1.758192 ] [ 4.508932 5.134782 2.974852 ] [ 3.702352 3.46043 0.9070332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.600247e-10 1.761403e-10 2.21582e-10 ] [ 1.350999e-10 3.710266e-10 1.758192e-10 ] [ 4.508932e-10 5.134782e-10 2.974852e-10 ] [ 3.702352e-10 3.46043e-10 9.070332e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0976355 -0.9897665 0.3965755 ] [ -0.9171509 0.5757715 -0.0042884 ] [ -0.5846297 -1.3772758 -1.7788454 ] [ 1.4041452 1.7912709 1.3865582 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.564293154601184e-10 -1.585780746351043e-09 6.353839944820705e-10 ] [ -1.469437729725679e-09 9.224876362229472e-10 -6.870774220638721e-12 ] [ -9.366800371653179e-10 -2.206639087153617e-09 -2.850024511897625e-09 ] [ 2.24968861164854e-09 2.869932357499375e-09 2.221511131418531e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1666695 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.675740459500426e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6436397 1.7130395 2.2516309 ] [ 1.2078064 3.6483323 1.6219854 ] [ 4.6497049 4.9763614 2.7808887 ] [ 3.661379 3.7291479 1.2013921 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6436397e-10 1.7130395e-10 2.2516309e-10 ] [ 1.2078064e-10 3.6483323e-10 1.6219854e-10 ] [ 4.6497049e-10 4.9763614e-10 2.780888700000001e-10 ] [ 3.661379e-10 3.7291479e-10 1.2013921e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.9e-06 1.1e-06 5.3e-06 ] [ -8.3e-06 4e-07 -8.7e-06 ] [ 1.17e-05 -5e-07 8.5e-06 ] [ -1.22e-05 -1.1e-06 -5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.425937192512e-14 1.76239428288e-15 8.491536090240001e-15 ] [ -1.329806595264e-14 6.408706483200001e-16 -1.393893660096e-14 ] [ 1.874546646336e-14 -8.010883104e-16 1.36185012768e-14 ] [ -1.954655477376e-14 -1.76239428288e-15 -8.17110076608e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.1543246 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.258138370134312e-19 } }