{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.019151e-10 2.9477867e-10 2.0424522e-10 ] [ 3.1932288e-10 1.8583342e-10 2.376293e-10 ] [ 1.8823691e-10 2.5999351e-10 4.3140022e-10 ] [ 1.5861569e-10 4.852290400000001e-10 3.4446464e-10 ] [ 3.0607942e-10 4.0177318e-10 1.2661334e-10 ] [ 3.6634245e-10 5.6919856e-10 2.7810558e-10 ] [ 4.0300363e-10 3.6303262e-10 3.818759e-10 ] ] "source-value" [ [ 1.019151 2.9477867 2.0424522 ] [ 3.1932288 1.8583342 2.376293 ] [ 1.8823691 2.5999351 4.3140022 ] [ 1.5861569 4.8522904 3.4446464 ] [ 3.0607942 4.0177318 1.2661334 ] [ 3.6634245 5.6919856 2.7810558 ] [ 4.0300363 3.6303262 3.818759 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.923407184759681e-12 -3.75213742825152e-12 5.19682008722688e-12 ] [ -2.79707994459264e-12 9.120871066890238e-12 1.060224357048192e-11 ] [ 6.80252149659264e-12 8.64870961674048e-12 -1.5124547300352e-11 ] [ 5.7622282167072e-12 -7.10997919012416e-12 -1.44147830573376e-12 ] [ -3.62220090430464e-12 3.3942111711648e-12 8.082179963625601e-12 ] [ 2.3664148689216e-13 -2.3287637183328e-12 -2.0171403655872e-13 ] [ -1.230567775371648e-11 -7.97307173574912e-12 -7.11350397868992e-12 ] ] "source-value" [ [ 0.0036971 -0.0023419 0.0032436 ] [ -0.0017458 0.0056928 0.0066174 ] [ 0.0042458 0.0053981 -0.00944 ] [ 0.0035965 -0.0044377 -0.0008997 ] [ -0.0022608 0.0021185 0.0050445 ] [ 0.0001477 -0.0014535 -0.0001259 ] [ -0.0076806 -0.0049764 -0.0044399 ] ] } "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" -5.167537105128519e-18 "source-value" -32.25323 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.168085110038996e-09 -8.230176222442139e-10 -2.539354774676724e-09 ] [ 1.097383959849731e-09 -3.32619572947626e-09 2.311390836580479e-09 ] [ 1.983673139025957e-09 1.826624101648913e-09 -1.392564654589046e-09 ] [ -2.111213768054093e-09 1.986874448131978e-09 3.868201505927203e-09 ] [ 1.278003418583674e-10 -1.278467729368381e-09 -7.621943514064455e-09 ] [ 1.151245452834799e-09 3.533788312274358e-09 1.062109317842563e-09 ] [ -8.080401547576512e-11 -1.919605620748731e-09 4.312161443197642e-09 ] ] "source-value" [ [ -1.3532123 -0.5136872 -1.5849406 ] [ 0.6849332 -2.0760481 1.4426567 ] [ 1.2381114 1.1400891 -0.8691705 ] [ -1.317716 1.2401095 2.4143415 ] [ 0.0797667 -0.7979568 -4.757243 ] [ 0.7185509 2.2056172 0.6629165 ] [ -0.0504339 -1.1981236 2.6914395 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.642709065317483e-18 "source-value" -28.977511 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] "source-value" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] } "instance-id" 1 }