{ "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" [ [ 3.044824 1.955008 1.363184 ] [ 4.804837 1.704442 0.3842414 ] [ 5.395877 3.200403 2.033527 ] [ 3.92549 3.943599 0.3069547 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.044824e-10 1.955008e-10 1.363184e-10 ] [ 4.804837e-10 1.704442e-10 3.842414e-11 ] [ 5.395877e-10 3.200403e-10 2.033527e-10 ] [ 3.92549e-10 3.943599e-10 3.069547e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.7635956 -1.536584 3.0873361 ] [ 5.1962241 -4.6759559 -4.1743754 ] [ 2.8114913 1.6893138 3.0614869 ] [ -1.2441198 4.5232261 -1.9744477 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.083647474286575e-08 -2.461878960695347e-09 4.946457719971851e-09 ] [ 8.325268769457522e-09 -7.491707222871823e-09 -6.688086672322648e-09 ] [ 4.5045056304426e-09 2.706579075554808e-09 4.905042736065467e-09 ] [ -1.993299657034372e-09 7.247007108012362e-09 -3.163413943932332e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5094824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.042934051478907e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8351168 2.0061829 0.6549827 ] [ 5.0108799 1.2090804 0.9934957 ] [ 5.7503991 3.3955447 1.3889596 ] [ 3.5746322 4.1926441 1.0504691 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8351168e-10 2.0061829e-10 6.549827e-11 ] [ 5.0108799e-10 1.2090804e-10 9.934957e-11 ] [ 5.7503991e-10 3.3955447e-10 1.3889596e-10 ] [ 3.5746322e-10 4.1926441e-10 1.0504691e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.03e-05 3e-07 7.6e-06 ] [ 1.1e-06 -5.4e-06 -5.9e-06 ] [ -7.5e-06 -5.5e-06 3.4e-06 ] [ -3.9e-06 1.06e-05 -5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.650241919424e-14 4.8065298624e-16 1.217654231808e-14 ] [ 1.76239428288e-15 -8.65175375232e-15 -9.45284206272e-15 ] [ -1.2016324656e-14 -8.8119714144e-15 5.44740051072e-15 ] [ -6.24848882112e-15 1.698307218048e-14 -8.17110076608e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9297943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43071076560131e-18 } }