{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0106236e-10 2.8039575e-10 2.837659e-10 ] [ 3.9745401e-10 2.8718296e-10 1.5295246e-10 ] [ 3.6365942e-10 1.107183e-10 3.060673400000001e-10 ] ] "source-value" [ [ 2.0106236 2.8039575 2.837659 ] [ 3.9745401 2.8718296 1.5295246 ] [ 3.6365942 1.107183 3.0606734 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.9242141215808e-12 -5.711759653152e-13 -8.0653571091072e-13 ] [ -1.47528423243264e-12 -7.900332917164801e-13 1.5332830261056e-12 ] [ -4.4909010681024e-13 1.36120925703168e-12 -7.2674731519488e-13 ] ] "source-value" [ [ 0.001201 -0.0003565 -0.0005034 ] [ -0.0009208 -0.0004931 0.000957 ] [ -0.0002803 0.0008496 -0.0004536 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.08561100582243e-18 "source-value" -6.775851 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -7.718229522444673e-10 -7.4976242213501e-10 1.052836560432021e-09 ] [ 1.878060379883077e-09 2.596614163839185e-09 -3.137196887015534e-09 ] [ -1.106237427638609e-09 -1.846851741704175e-09 2.084360486801175e-09 ] ] "source-value" [ [ -0.481734 -0.4679649 0.6571289 ] [ 1.1721931 1.6206791 -1.9580843 ] [ -0.6904591 -1.1527142 1.3009555 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.043727593537423e-18 "source-value" -6.5144353 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.987433e-10 2.877912e-10 2.797409e-10 ] [ 3.916588e-10 2.799592e-10 1.620454e-10 ] [ 3.717737e-10 1.105466e-10 3.009994e-10 ] ] "source-value" [ [ 1.987433 2.877912 2.797409 ] [ 3.916588 2.799592 1.620454 ] [ 3.717737 1.105466 3.009994 ] ] } "instance-id" 1 }