{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.4867626e-10 8.214949000000001e-11 3.1321523e-10 ] [ 1.5292978e-10 3.8358253e-10 2.1296492e-10 ] [ 1.2717057e-10 1.643672e-10 2.9806093e-10 ] [ 2.4649675e-10 5.0636435e-10 3.9212454e-10 ] [ 4.816139500000001e-10 2.620257e-10 2.3647815e-10 ] [ 3.4080726e-10 3.56926e-10 7.199276e-11 ] [ 4.678777300000001e-10 4.2401424e-10 4.0834712e-10 ] ] "source-value" [ [ 3.4867626 0.8214949 3.1321523 ] [ 1.5292978 3.8358253 2.1296492 ] [ 1.2717057 1.643672 2.9806093 ] [ 2.4649675 5.0636435 3.9212454 ] [ 4.8161395 2.620257 2.3647815 ] [ 3.4080726 3.56926 0.7199276 ] [ 4.6787773 4.2401424 4.0834712 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.15388760230016e-12 4.14274808840256e-12 5.78193498914304e-12 ] [ 3.693017110944e-13 -5.67378806723904e-12 4.16517856109376e-12 ] [ -8.20042059824064e-12 2.74821355765824e-12 -4.6126664912832e-12 ] [ -3.09091913684736e-12 -3.46935325468032e-12 1.53905086194048e-12 ] [ 3.71897237220096e-12 1.165711665761664e-11 1.99262706328896e-12 ] [ 1.1030986034208e-12 -2.30441063369664e-12 -5.70342833472384e-12 ] [ 7.25369443300992e-12 -7.100526348061439e-12 -3.16253643179712e-12 ] ] "source-value" [ [ -0.0007202 0.0025857 0.0036088 ] [ 0.0002305 -0.0035413 0.0025997 ] [ -0.0051183 0.0017153 -0.002879 ] [ -0.0019292 -0.0021654 0.0009606 ] [ 0.0023212 0.0072758 0.0012437 ] [ 0.0006885 -0.0014383 -0.0035598 ] [ 0.0045274 -0.0044318 -0.0019739 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "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" -2.88989756102415e-18 "source-value" -18.037322 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.26373358444522e-08 -3.466731132422718e-08 -5.705904018038299e-09 ] [ -3.747593799550827e-08 7.954240873271872e-09 -1.626248795809235e-08 ] [ -1.541347037386346e-08 -1.248100442198361e-08 3.105493320456701e-08 ] [ -2.532598235649149e-09 3.386993237313966e-08 8.274091723400603e-09 ] [ 3.289387852508286e-08 -2.940601804760269e-09 -2.22352154264231e-10 ] [ 6.498700103119687e-09 1.027100637154449e-08 -2.920890321925164e-08 ] [ 3.392092292583792e-09 -2.006262066984954e-09 1.207062242167891e-08 ] ] "source-value" [ [ 7.8876047 -21.637634 -3.5613452 ] [ -23.3906409 4.9646467 -10.1502467 ] [ -9.6203316 -7.7900303 19.3829649 ] [ -1.5807235 21.1399492 5.1642819 ] [ 20.5307443 -1.8353793 -0.1387813 ] [ 4.0561696 6.410658 -18.2307636 ] [ 2.1171775 -1.2522103 7.53389 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 8.639815774100758e-19 "source-value" 5.3925489 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] "source-value" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] } "instance-id" 1 }