{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.1748569e-10 4.3496349e-10 9.588399e-11 ] [ 2.1635834e-10 4.235222300000001e-10 3.3358026e-10 ] [ 3.2101408e-10 2.5154878e-10 2.0666342e-10 ] ] "source-value" [ [ 2.1748569 4.3496349 0.9588399 ] [ 2.1635834 4.2352223 3.3358026 ] [ 3.2101408 2.5154878 2.0666342 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.010883104e-16 -1.137545400768e-14 1.7992443451584e-13 ] [ 6.4519652519616e-13 -1.0502267749344e-12 -9.597037958592001e-13 ] [ -6.4583739584448e-13 1.06160222894208e-12 7.796191436812801e-13 ] ] "source-value" [ [ 5e-07 -7.1e-06 0.0001123 ] [ 0.0004027 -0.0006555 -0.000599 ] [ -0.0004031 0.0006626 0.0004866 ] ] } "species" { "source-value" [ "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" -1.051419371123859e-18 "source-value" -6.5624436 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.940129022608193e-09 -3.339756552394712e-09 3.436478192598124e-10 ] [ 1.462043524403025e-09 -2.520899302181729e-09 3.322760502583603e-10 ] [ -3.402172547011217e-09 5.860655854576441e-09 -6.759238695181728e-10 ] ] "source-value" [ [ 1.2109333 -2.0845121 0.2144881 ] [ 0.9125358 -1.5734216 0.2073904 ] [ -2.1234691 3.6579337 -0.4218785 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.45966735529333e-19 "source-value" -5.2801091 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.04685e-10 4.568745e-10 9.582477000000001e-11 ] [ 2.137656e-10 4.28611e-10 3.219993e-10 ] [ 3.364075e-10 2.24549e-10 2.183036e-10 ] ] "source-value" [ [ 2.04685 4.568745 0.9582477 ] [ 2.137656 4.28611 3.219993 ] [ 3.364075 2.24549 2.183036 ] ] } "instance-id" 1 }