{ "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" [ [ 2.689863 2.613928 1.941703 ] [ 2.080356 5.103994 1.950756 ] [ 1.651882 3.89841 3.770183 ] [ 3.604737 2.326315 3.946353 ] [ 4.359532 3.977463 2.369793 ] [ 3.455978 5.487629 3.928773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.689863e-10 2.613928e-10 1.941703e-10 ] [ 2.080356e-10 5.103994e-10 1.950756e-10 ] [ 1.651882e-10 3.89841e-10 3.770183e-10 ] [ 3.604737e-10 2.326315e-10 3.946353e-10 ] [ 4.359532e-10 3.977463000000001e-10 2.369793e-10 ] [ 3.455978e-10 5.487629000000001e-10 3.928773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -28.4319045 -17.6139265 -48.5351696 ] [ -13.7285966 20.8418602 -41.9167939 ] [ -27.5523187 -22.2231499 46.5907082 ] [ 0.3564008 -21.0434689 48.6045943 ] [ 55.7703453 26.1445295 -18.7470027 ] [ 13.5860736 13.8941556 14.0036638 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.555293267471832e-08 -2.822062123878957e-08 -7.77619140196829e-08 ] [ -2.199563650891437e-08 3.339234114642201e-08 -6.715810720547206e-08 ] [ -4.414368086997065e-08 -3.560541121031386e-08 7.464654342455485e-08 ] [ 5.710170293944167e-10 -3.37153538921119e-08 7.787314465092896e-08 ] [ 8.935394337360318e-08 4.188815392671591e-08 -3.003600943601448e-08 ] [ 2.176728949038809e-08 2.22608912680774e-08 2.243634274590329e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 31.458402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.040191621212797e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2965091 2.3894476 1.5065208 ] [ 2.0448481 5.2657363 1.4998559 ] [ 1.4166479 3.7680511 4.2798595 ] [ 3.7580722 2.0469366 4.1274774 ] [ 4.9026131 4.0686528 2.3752212 ] [ 3.4236576 5.8689146 4.1186263 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2965091e-10 2.3894476e-10 1.5065208e-10 ] [ 2.0448481e-10 5.2657363e-10 1.4998559e-10 ] [ 1.4166479e-10 3.7680511e-10 4.2798595e-10 ] [ 3.7580722e-10 2.0469366e-10 4.1274774e-10 ] [ 4.9026131e-10 4.0686528e-10 2.3752212e-10 ] [ 3.4236576e-10 5.8689146e-10 4.1186263e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.61e-05 3.19e-05 5.5e-06 ] [ -3.6e-06 -9.7e-06 5.4e-06 ] [ 2.47e-05 -1.6e-06 -4e-07 ] [ -1.18e-05 -3.1e-06 -4e-07 ] [ -2.66e-05 -1.85e-05 3.1e-06 ] [ -8.8e-06 1.1e-06 -1.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.181680980288e-14 5.110943420352001e-14 8.8119714144e-15 ] [ -5.76783583488e-15 -1.554111322176e-14 8.65175375232e-15 ] [ 3.957376253376001e-14 -2.56348259328e-15 -6.408706483200001e-16 ] [ -1.890568412544e-14 -4.96674752448e-15 -6.408706483200001e-16 ] [ -4.261789811328e-14 -2.96402674848e-14 4.96674752448e-15 ] [ -1.409915426304e-14 1.76239428288e-15 -2.130894905664e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.167678 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.430129908342251e-18 } }