{ "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" [ [ 0.0780347 0.0112197 1.661349 ] [ 1.004167 1.583481 0.6099477 ] [ 1.186614 2.044688 2.371218 ] [ 2.525789 0.4216906 0.1723184 ] [ 2.89399 2.924329 1.948013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.80347e-12 1.12197e-12 1.661349e-10 ] [ 1.004167e-10 1.583481e-10 6.099477e-11 ] [ 1.186614e-10 2.044688e-10 2.371218e-10 ] [ 2.525789e-10 4.216906e-11 1.723184e-11 ] [ 2.89399e-10 2.924329e-10 1.948013e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8803648 -8.065861 2.8214695 ] [ -6.2970864 2.3177268 -13.5755878 ] [ -4.3925138 6.4198083 16.2924379 ] [ 9.0469227 -6.3480712 -7.0117995 ] [ 8.5230424 5.6763971 1.4734799 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.102355962513527e-08 -1.292293392082251e-08 4.520492469200266e-09 ] [ -1.008904460923764e-08 3.713407692361597e-09 -2.175048938677771e-08 ] [ -7.037582916901366e-09 1.028566676827779e-08 2.610336309921585e-08 ] [ 1.449476804012481e-08 -1.01707312638138e-08 -1.123414122863713e-08 ] [ 1.365541927136712e-08 9.09459072399692e-09 2.360775046998722e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.0633266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.510166881194754e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.3667307 -0.6565852 1.5753423 ] [ 0.5439447 1.3154184 0.6448838 ] [ 1.1319729 2.8512285 2.4264061 ] [ 2.8956909 0.9705063 0.1667336 ] [ 3.483717 2.5048402 1.9494803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.667307e-11 -6.565852e-11 1.5753423e-10 ] [ 5.439446999999999e-11 1.3154184e-10 6.448838e-11 ] [ 1.1319729e-10 2.8512285e-10 2.4264061e-10 ] [ 2.8956909e-10 9.705063e-11 1.667336e-11 ] [ 3.483717e-10 2.5048402e-10 1.9494803e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.92e-05 1.34e-05 -1.13e-05 ] [ -1.92e-05 -2.41e-05 -4.3e-06 ] [ -4.7e-06 -9.4e-06 2.66e-05 ] [ 2.01e-05 -1.65e-05 -8e-07 ] [ 2.3e-05 3.66e-05 -1.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.076179111936e-14 2.146916671872e-14 -1.810459581504e-14 ] [ -3.076179111936e-14 -3.861245656128e-14 -6.889359469440001e-15 ] [ -7.53023011776e-15 -1.506046023552e-14 4.261789811328e-14 ] [ 3.220375007808e-14 -2.64359142432e-14 -1.28174129664e-15 ] [ 3.68500622784e-14 5.863966432128e-14 -1.634220153216e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.5930512 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.056323249237738e-18 } }