{ "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" [ [ 0.3126518 0.5217928 0.1846885 ] [ 0.8333114 2.588069 2.680495 ] [ 2.642381 0.0430457 2.992394 ] [ 2.45603 2.243401 1.184533 ] [ 2.245972 1.834771 2.762862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126518e-11 5.217928e-11 1.846885e-11 ] [ 8.333114000000001e-11 2.588069e-10 2.680495e-10 ] [ 2.642381e-10 4.30457e-12 2.992394e-10 ] [ 2.45603e-10 2.243401e-10 1.184533e-10 ] [ 2.245972e-10 1.834771e-10 2.762862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2937244 0.4912982 -0.0345794 ] [ -17.1421274 8.9748024 -0.080765 ] [ 2.2521284 -8.9634075 1.883925 ] [ 2.1785406 3.5114087 -15.2081643 ] [ 12.417734 -4.0141017 13.4395836 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.705983666385075e-10 7.871464898811226e-10 -5.540230624129152e-11 ] [ -2.746471575105509e-08 1.437921858157973e-08 -1.29399794778912e-10 ] [ 3.608307469519711e-09 -1.436096193920338e-08 3.01838059034064e-09 ] [ 3.490406816783605e-09 5.625896925213721e-09 -2.43661652867452e-08 ] [ 1.989540309811327e-08 -6.431299897253536e-09 2.15325866372071e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.40943006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.559792699847413e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.4574023 1.6510281 0.3955556 ] [ 0.0798212 2.4568297 2.5874039 ] [ 3.3400925 0.4875057 2.5940876 ] [ 2.6155141 0.6823668 0.3495961 ] [ 1.997516 1.9533492 3.8783292 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.574023e-11 1.6510281e-10 3.955556e-11 ] [ 7.98212e-12 2.4568297e-10 2.5874039e-10 ] [ 3.3400925e-10 4.875057e-11 2.5940876e-10 ] [ 2.6155141e-10 6.823668000000001e-11 3.495961e-11 ] [ 1.997516e-10 1.9533492e-10 3.8783292e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.19e-05 -1.3e-06 1.48e-05 ] [ -2.34e-05 1.75e-05 2.07e-05 ] [ 9e-07 -1.9e-06 -1.39e-05 ] [ 1.73e-05 -7.3e-06 1.26e-05 ] [ -6.7e-06 -6.9e-06 -3.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.906590178752e-14 -2.08282960704e-15 2.371221398784e-14 ] [ -3.749093292672001e-14 2.8038090864e-14 3.316505605055999e-14 ] [ 1.44195895872e-15 -3.04413557952e-15 -2.227025502912e-14 ] [ 2.771765553984e-14 -1.169588933184e-14 2.018742542208e-14 ] [ -1.073458335936e-14 -1.105501868352e-14 -5.479444043136e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.976836 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.239335987195579e-18 } }