{ "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" [ [ 1.040169 0.3467498 1.049872 ] [ 0.0600036 1.405044 1.572488 ] [ 2.420904 2.65585 0.1683769 ] [ 1.553585 1.595169 0.3590691 ] [ 2.059971 2.654503 2.612695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.040169e-10 3.467498e-11 1.049872e-10 ] [ 6.00036e-12 1.405044e-10 1.572488e-10 ] [ 2.420904e-10 2.65585e-10 1.683769e-11 ] [ 1.553585e-10 1.595169e-10 3.590691e-11 ] [ 2.059971e-10 2.654503e-10 2.612695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 13.576287 -82.6081568 6.3784336 ] [ -48.6499935 33.0885395 30.7507877 ] [ 53.5700455 63.7679528 -14.2048913 ] [ -19.189216 -17.3217217 -29.2743832 ] [ 0.6928771 3.0733863 6.3500533 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.175160962867097e-08 -1.323528575123406e-07 1.021937719124518e-08 ] [ -7.794588218777197e-08 5.301368440331733e-08 4.926819312412421e-08 ] [ 8.582867447529225e-08 1.021675231324379e-07 -2.275874474186532e-08 ] [ -3.074451324668129e-08 -2.775245753974403e-08 -4.690273235138029e-08 ] [ 1.110111490707704e-09 4.924107676547015e-09 1.017390693809389e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 49.082576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.863895575583919e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7582143 -0.6660311 0.9661504 ] [ 0.2921175 1.5335236 2.0459513 ] [ 2.8600381 3.1320149 0.4318481 ] [ 1.3404213 1.4210844 -0.2692611 ] [ 1.8838413 3.2367239 2.5878122 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.582143e-11 -6.660311000000001e-11 9.661504e-11 ] [ 2.921175e-11 1.5335236e-10 2.0459513e-10 ] [ 2.8600381e-10 3.1320149e-10 4.318481e-11 ] [ 1.3404213e-10 1.4210844e-10 -2.692611e-11 ] [ 1.8838413e-10 3.2367239e-10 2.5878122e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.37e-05 -5e-06 -1.13e-05 ] [ 4.03e-05 1.02e-05 -3e-07 ] [ -1.4e-05 1.36e-05 1.88e-05 ] [ 8.9e-06 -1.22e-05 1.91e-05 ] [ -1.15e-05 -6.5e-06 -2.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.797158591296e-14 -8.010883104e-15 -1.810459581504e-14 ] [ 6.456771781824e-14 1.634220153216e-14 -4.8065298624e-16 ] [ -2.24304726912e-14 2.178960204288e-14 3.012092047104e-14 ] [ 1.425937192512e-14 -1.954655477376e-14 3.060157345728e-14 ] [ -1.84250311392e-14 -1.04141480352e-14 -4.197702746496e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.268028 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805337102411978e-18 } }