{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.10065 -0.7895552 0.0097942 ] [ 0.3803502 -0.3693297 -4.1418613 ] [ -4.9172141 -1.6087387 2.6916515 ] [ 1.977087 4.4919006 1.2852383 ] [ -2.0049091 -5.4333899 -5.4837869 ] [ 1.2707846 2.629098 -2.7180522 ] [ 3.1932514 1.0800149 8.3570165 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.612590782121e-10 -1.265006892693197e-09 1.56920383887228e-11 ] [ 6.093882031772268e-10 -5.917314155822298e-10 -6.635993396128864e-09 ] [ -7.878245535395338e-09 -2.577483555351536e-09 4.31250114017105e-09 ] [ 3.167642594785158e-09 7.196818183570581e-09 2.059178773381882e-09 ] [ -3.212218513313969e-09 -8.705250341191596e-09 -8.785995237015294e-09 ] [ 2.036021392967036e-09 4.212279384096131e-09 -4.354799724832294e-09 ] [ 5.116152779567786e-09 1.730374637151847e-09 1.338941656625246e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.650398 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.026817208640033e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8659956 1.503928 3.7054286 ] [ 1.1489719 3.1011164 1.0394185 ] [ 0.8428839 3.6676544 3.3690092 ] [ 2.6712094 5.1091755 3.7408842 ] [ 3.215202 2.0963621 1.7896231 ] [ 6.2862903 4.900959 1.7232168 ] [ 4.3782899 3.9785015 2.6043815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8659956e-10 1.503928e-10 3.7054286e-10 ] [ 1.1489719e-10 3.1011164e-10 1.0394185e-10 ] [ 8.428839e-11 3.6676544e-10 3.3690092e-10 ] [ 2.6712094e-10 5.109175500000001e-10 3.7408842e-10 ] [ 3.215202e-10 2.0963621e-10 1.7896231e-10 ] [ 6.286290300000001e-10 4.900959e-10 1.7232168e-10 ] [ 4.378289900000001e-10 3.9785015e-10 2.6043815e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 4.3e-06 2e-06 ] [ -1.4e-06 4.1e-06 8e-07 ] [ -2.3e-06 -3e-07 -1e-07 ] [ 1.3e-06 -4.3e-06 -7e-06 ] [ 3e-06 2.1e-06 -2e-06 ] [ 1.1e-06 4e-06 -2.4e-06 ] [ -5.5e-06 -9.9e-06 8.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.088271209199999e-15 6.8893595262e-15 3.204353268e-15 ] [ -2.2430472876e-15 6.568924199399999e-15 1.2817413072e-15 ] [ -3.685006258199999e-15 -4.806529901999999e-16 -1.602176634e-16 ] [ 2.0828296242e-15 -6.8893595262e-15 -1.1215236438e-14 ] [ 4.806529901999999e-15 3.364570931399999e-15 -3.204353268e-15 ] [ 1.7623942974e-15 6.408706535999999e-15 -3.845223921599999e-15 ] [ -8.811971486999999e-15 -1.58615486766e-14 1.39389367158e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.490038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.802213021137209e-18 } }