{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2775877 -2.117631 0.0221812 ] [ 2.0677205 -2.7259986 2.862615 ] [ -0.1945548 6.2109549 -6.6453778 ] [ -2.6800452 3.2157239 5.3486727 ] [ -0.2748745 0.1697402 -2.4671221 ] [ -2.6861544 -3.1613901 1.7312434 ] [ 2.4903206 -1.5913992 -0.8522124 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.046921143961644e-09 -3.392818879681324e-09 3.553820006128896e-11 ] [ 3.312853443448886e-09 -4.367531225253531e-09 4.586414827351392e-09 ] [ -3.117111520244198e-10 9.951046733623202e-09 -1.064706894754334e-08 ] [ -4.29390576212726e-09 5.152157651527797e-09 8.569518352251213e-09 ] [ -4.403974975540896e-10 2.719537800499162e-10 -3.952765349279e-09 ] [ -4.303693779539051e-09 -5.065105307448574e-09 2.773757700394303e-09 ] [ 3.989933443616628e-09 -2.549702592599823e-09 -1.365394783235858e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.417323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.751868743232212e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5038051 1.7345957 1.9716344 ] [ 2.8097871 2.6593961 4.1851319 ] [ 2.3860205 4.1312925 2.2722829 ] [ 4.5564272 2.917055 2.4268083 ] [ 5.1544999 2.7990561 4.7606994 ] [ 4.4641324 5.1969471 1.644359 ] [ 4.0130837 4.7846795 3.9842401 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5038051e-10 1.7345957e-10 1.9716344e-10 ] [ 2.8097871e-10 2.6593961e-10 4.1851319e-10 ] [ 2.3860205e-10 4.1312925e-10 2.2722829e-10 ] [ 4.5564272e-10 2.917055e-10 2.4268083e-10 ] [ 5.154499900000001e-10 2.7990561e-10 4.7606994e-10 ] [ 4.4641324e-10 5.1969471e-10 1.644359e-10 ] [ 4.0130837e-10 4.784679500000001e-10 3.9842401e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-06 -5.67e-05 3.01e-05 ] [ 5.93e-05 2.35e-05 3.45e-05 ] [ 8.85e-05 1.31e-05 -7.97e-05 ] [ -7.4e-05 4.86e-05 -3.42e-05 ] [ -2.52e-05 -4.16e-05 -1.6e-05 ] [ -2.41e-05 -4.9e-06 4.15e-05 ] [ -1.85e-05 1.8e-05 2.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-15 -9.084341439936e-14 4.822551628608e-14 ] [ 9.500907361344e-14 3.76511505888e-14 5.52750934176e-14 ] [ 1.417926309408e-13 2.098851373248e-14 -1.2769347667776e-13 ] [ -1.185610699392e-13 7.786578377088e-14 -5.479444043136e-14 ] [ -4.037485084416e-14 -6.665054742528e-14 -2.56348259328e-14 ] [ -3.861245656128e-14 -7.850665441919999e-15 6.64903297632e-14 ] [ -2.96402674848e-14 2.88391791744e-14 3.813180357504e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.715697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.76097950041767e-18 } }