{ "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" [ [ 1.79141 2.530899 1.169625 ] [ 2.427567 4.27143 3.28825 ] [ 4.049049 2.026656 0.8582536 ] [ 3.63347 2.471275 3.089518 ] [ 3.6938 4.301317 1.502863 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.79141e-10 2.530899e-10 1.169625e-10 ] [ 2.427567e-10 4.27143e-10 3.28825e-10 ] [ 4.049049e-10 2.026656e-10 8.582536e-11 ] [ 3.63347e-10 2.471275e-10 3.089518e-10 ] [ 3.6938e-10 4.301317e-10 1.502863e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -42.3683289 62.0616376 68.0322261 ] [ -0.5694802 0.1055652 -5.1588476 ] [ 136.2536492 -80.9810349 -76.9094208 ] [ -50.694041 -80.1520788 82.0292355 ] [ -42.6217991 98.9659108 -67.9931932 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.788154602594498e-08 9.943370481128223e-08 1.089996421183996e-07 ] [ -9.124078624485082e-10 1.691340954100762e-10 -8.26538501499019e-09 ] [ 2.183024112469247e-07 -1.297459208449689e-07 -1.232224759250292e-07 ] [ -8.122080730407665e-08 -1.284177867618793e-07 1.314253233401974e-07 ] [ -6.828765005445447e-08 1.585608685399382e-07 -1.089371045185775e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 46.97256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.525833745112525e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2912295 2.4774274 1.1377567 ] [ 2.1186355 4.2900441 3.2574302 ] [ 4.1195188 1.9505788 0.7060105 ] [ 3.9606231 2.0658732 3.6085236 ] [ 4.1052891 4.8176535 1.1987885 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2912295e-10 2.4774274e-10 1.1377567e-10 ] [ 2.1186355e-10 4.2900441e-10 3.2574302e-10 ] [ 4.1195188e-10 1.9505788e-10 7.060105e-11 ] [ 3.9606231e-10 2.0658732e-10 3.6085236e-10 ] [ 4.1052891e-10 4.817653499999999e-10 1.1987885e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.8e-06 -1.65e-05 6.2e-06 ] [ -2.42e-05 2.27e-05 -1.19e-05 ] [ -7.7e-06 -2.57e-05 -3.48e-05 ] [ 2.04e-05 -4.9e-06 1.57e-05 ] [ 2.13e-05 2.44e-05 2.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.570133088384e-14 -2.64359142432e-14 9.93349504896e-15 ] [ -3.877267422336e-14 3.636940929216e-14 -1.906590178752e-14 ] [ -1.233675998016e-14 -4.117593915456e-14 -5.575574640383999e-14 ] [ 3.268440306432e-14 -7.850665441919999e-15 2.515417294656e-14 ] [ 3.412636202304e-14 3.909310954752e-14 3.989419785791999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271447337016e-18 } }