{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6305471 0.004372 1.304235 ] [ 0.7154426 1.383697 2.938133 ] [ 2.486494 1.164331 0.5043625 ] [ 2.840403 0.4835428 2.252778 ] [ 2.544628 2.936148 1.00011 ] [ 2.473494 2.502288 2.980444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.305471000000001e-11 4.372e-13 1.304235e-10 ] [ 7.154426000000001e-11 1.383697e-10 2.938133e-10 ] [ 2.486494e-10 1.164331e-10 5.043625000000001e-11 ] [ 2.840403e-10 4.835428e-11 2.252778e-10 ] [ 2.544628e-10 2.936148e-10 1.00011e-10 ] [ 2.473494e-10 2.502288e-10 2.980444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.3823772 -0.2570085 -3.5054241 ] [ -4.9817836 -3.8511293 0.5741656 ] [ -21.0648291 -101.6751623 -97.3876184 ] [ 6.7894764 -25.0900772 63.9171588 ] [ 4.0460308 128.5795194 15.1997159 ] [ 8.8287282 2.2938579 21.2020022 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.022569553496696e-08 -4.117730100468768e-10 -5.616308539008882e-09 ] [ -7.981697213804858e-09 -6.170189328137869e-09 9.199147007876046e-10 ] [ -3.374957670516751e-08 -1.629015679531055e-07 -1.560321653558719e-07 ] [ 1.087794035555335e-08 -4.019873510390713e-08 1.02406577497321e-07 ] [ 6.482455954796721e-09 2.060070998963801e-07 2.435262945778203e-08 ] [ 1.414518191343767e-08 3.675165498817384e-09 3.396935223899017e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4261901 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.510242140143641e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9938221 -0.365045 1.6365925 ] [ 0.8758371 1.7907461 2.1017447 ] [ 1.8229479 1.1219833 0.2133867 ] [ 2.8453983 0.7287635 2.1395563 ] [ 2.7048571 2.7984235 1.3605108 ] [ 2.4481462 2.3995073 3.5282715 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.938221e-11 -3.65045e-11 1.6365925e-10 ] [ 8.758371e-11 1.7907461e-10 2.1017447e-10 ] [ 1.8229479e-10 1.1219833e-10 2.133867e-11 ] [ 2.8453983e-10 7.287635e-11 2.1395563e-10 ] [ 2.7048571e-10 2.7984235e-10 1.3605108e-10 ] [ 2.4481462e-10 2.3995073e-10 3.5282715e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 -2.48e-05 -1.79e-05 ] [ -6e-07 7.9e-06 -1.3e-06 ] [ -5.2e-06 2.3e-05 2.28e-05 ] [ 6.8e-06 -1.7e-05 1.36e-05 ] [ -4.9e-06 -1.01e-05 1.64e-05 ] [ 6.1e-06 2.1e-05 -3.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 -3.973398019584e-14 -2.867896151232001e-14 ] [ -9.6130597248e-16 1.265719530432e-14 -2.08282960704e-15 ] [ -8.33131842816e-15 3.68500622784e-14 3.652962695424e-14 ] [ 1.089480102144e-14 -2.72370025536e-14 2.178960204288e-14 ] [ -7.850665441919999e-15 -1.618198387008e-14 2.627569658112e-14 ] [ 9.77327738688e-15 3.36457090368e-14 -5.36729167968e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }