{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.107976 2.819188 1.252407 ] [ 2.630591 3.411672 3.024039 ] [ 3.968262 4.362454 1.692316 ] [ 3.394725 3.292047 0.1208017 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.107976e-10 2.819188e-10 1.252407e-10 ] [ 2.630591e-10 3.411672e-10 3.024039e-10 ] [ 3.968262e-10 4.362454e-10 1.692316e-10 ] [ 3.394725e-10 3.292047e-10 1.208017e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4949687 -0.1148557 -0.5216272 ] [ -2.6338848 -1.9582771 1.9834067 ] [ 5.8372197 6.8697219 4.2008606 ] [ -3.6983037 -4.7965891 -5.6626401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.930272857013557e-10 -1.840191188217138e-10 -8.357389114988446e-10 ] [ -4.219948683207763e-09 -3.137505812517281e-09 3.177767870459048e-09 ] [ 9.35225701086449e-09 1.100650791025808e-08 6.73052069601122e-09 ] [ -5.925335773575745e-09 -7.684982978919089e-09 -9.072549654971422e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.4456281 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.192921136727382e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9916429 2.7611572 1.1617332 ] [ 2.6369608 3.2966016 2.7749016 ] [ 4.2906501 4.6741761 1.7932214 ] [ 3.1823002 3.1534261 0.3597075 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.916429e-11 2.7611572e-10 1.1617332e-10 ] [ 2.6369608e-10 3.2966016e-10 2.7749016e-10 ] [ 4.2906501e-10 4.6741761e-10 1.7932214e-10 ] [ 3.1823002e-10 3.1534261e-10 3.597075e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.67e-05 4.22e-05 -1.05e-05 ] [ 2.29e-05 -9.7e-06 2.21e-05 ] [ -4.93e-05 8e-07 2.8e-06 ] [ -1.03e-05 -3.33e-05 -1.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.879988246779999e-14 6.761185395480001e-14 -1.6822854657e-14 ] [ 3.66898449186e-14 -1.55411133498e-14 3.54081036114e-14 ] [ -7.89873080562e-14 1.2817413072e-15 4.486094575199999e-15 ] [ -1.65024193302e-14 -5.33524819122e-14 -2.30713435296e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689829154163525e-18 } }