{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.009597 0.3628337 1.078601 ] [ 0.0352367 0.1167127 2.680629 ] [ 0.3335965 1.756245 2.167544 ] [ 2.066416 0.0072977 2.832654 ] [ 2.311694 1.962933 1.086024 ] [ 2.552148 1.611374 2.965257 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.009597e-10 3.628337e-11 1.078601e-10 ] [ 3.52367e-12 1.167127e-11 2.680629e-10 ] [ 3.335965e-11 1.756245e-10 2.167544e-10 ] [ 2.066416e-10 7.2977e-13 2.832654e-10 ] [ 2.311694e-10 1.962933e-10 1.086024e-10 ] [ 2.552148e-10 1.611374e-10 2.965257e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.3036537 -14.9715252 -28.0113102 ] [ -17.8449989 -21.9493545 18.0302482 ] [ -6.725842 34.3703992 4.1319643 ] [ 3.1030985 -25.6611013 4.3622706 ] [ 3.8727271 6.6042082 -10.1195665 ] [ 10.2913616 21.6073737 11.6063936 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.170174330096764e-08 -2.398702785078217e-08 -4.487906669016586e-08 ] [ -2.85908402713357e-08 -3.516674291128274e-08 2.888764237126055e-08 ] [ -1.077598689637583e-08 5.506745049949229e-08 6.620136653982165e-09 ] [ 4.971711909700449e-09 -4.111361690556702e-08 6.989128026505161e-09 ] [ 6.204792869478581e-09 1.05811080641112e-08 -1.621333299250916e-08 ] [ 1.648857908756485e-08 3.461882926424612e-08 1.859549263092714e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.3226272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.119082395332845e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3892296 -0.2069273 0.7386938 ] [ -0.1801406 0.1156911 2.5301866 ] [ 0.3820927 2.4205989 2.6076384 ] [ 2.1019117 -0.4574294 3.0203116 ] [ 1.951447 2.0979843 0.8161338 ] [ 2.6641477 1.8474784 3.0977449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3892296e-10 -2.069273e-11 7.386938e-11 ] [ -1.801406e-11 1.156911e-11 2.5301866e-10 ] [ 3.820927e-11 2.4205989e-10 2.6076384e-10 ] [ 2.1019117e-10 -4.574294e-11 3.0203116e-10 ] [ 1.951447e-10 2.0979843e-10 8.161338e-11 ] [ 2.6641477e-10 1.8474784e-10 3.0977449e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.88e-05 -3.13e-05 -1.16e-05 ] [ -1.5e-06 -2.7e-05 9.5e-06 ] [ -1.15e-05 3.62e-05 -1.7e-06 ] [ 3.2e-06 -3.12e-05 -4e-06 ] [ 2.14e-05 2.68e-05 -1.13e-05 ] [ 7.2e-06 2.66e-05 1.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.012092071919999e-14 -5.014812864419999e-14 -1.85852489544e-14 ] [ -2.403264951e-15 -4.325876911799999e-14 1.5220678023e-14 ] [ -1.8425031291e-14 5.799879415079998e-14 -2.7237002778e-15 ] [ 5.1269652288e-15 -4.998791098079999e-14 -6.408706535999999e-15 ] [ 3.42865799676e-14 4.293833379119999e-14 -1.81045959642e-14 ] [ 1.15356717648e-14 4.26178984644e-14 3.06015737094e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014505636701e-18 } }