{ "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" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2383069 -1.5394591 -2.4755852 ] [ 0.8119916 -0.5149543 1.9201105 ] [ 2.7685584 1.8373499 0.9916385 ] [ -2.3422431 0.2170636 -0.4361638 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.983986364555324e-09 -2.466485378697809e-09 -3.966324730238492e-09 ] [ 1.300953957805985e-09 -8.250477402404295e-10 3.076356152452599e-09 ] [ 4.435719541799455e-09 2.943759054009218e-09 1.588780020985181e-09 ] [ -3.752687135050117e-09 3.477742251466828e-10 -6.988114431992871e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5826518 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.054657081682704e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.4083252 0.8756006 0.2932719 ] [ 1.1487665 0.0287178 1.6888461 ] [ 0.7976026 2.7793708 0.3970197 ] [ 2.3547178 1.9324759 1.7925576 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.083252e-11 8.756006e-11 2.932719e-11 ] [ 1.1487665e-10 2.87178e-12 1.6888461e-10 ] [ 7.976026000000001e-11 2.7793708e-10 3.970197e-11 ] [ 2.3547178e-10 1.9324759e-10 1.7925576e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.9e-06 -2.2e-06 1.53e-05 ] [ -5.3e-06 4.37e-05 -3.07e-05 ] [ 5.5e-06 -3.54e-05 6.9e-06 ] [ -6.1e-06 -6.1e-06 8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.45284206272e-15 -3.52478856576e-15 2.451330229824e-14 ] [ -8.491536090240001e-15 7.001511832895999e-14 -4.918682225856e-14 ] [ 8.8119714144e-15 -5.671705237632e-14 1.105501868352e-14 ] [ -9.77327738688e-15 -9.77327738688e-15 1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736330714483474e-18 } }