{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3468098 -0.9898145 4.7986186 ] [ -1.9894973 0.4097668 1.6333901 ] [ 3.9606172 -9.6265384 1.1552917 ] [ 29.7905697 6.7192331 8.1597453 ] [ -27.4148798 3.487353 -15.7470457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.964357094002213e-09 -1.585857663894393e-09 7.688234596397792e-09 ] [ -3.187526087466088e-09 6.565187923489511e-10 2.616979452426923e-09 ] [ 6.345608334058504e-09 -1.542341489078374e-08 1.850981367194138e-09 ] [ 4.772975468688838e-08 1.076539827121939e-08 1.307335325905132e-08 ] [ -4.392347983947859e-08 5.587355491109802e-09 -2.522954867507017e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.7289463673103271 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.770077471143788e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1152099 0.4518586 2.9364072 ] [ 0.7183959 2.5839196 1.9496404 ] [ 2.6628932 0.2273294 1.1388779 ] [ 3.0890439 2.4963366 1.7278177 ] [ 0.8676801 1.2686776 -0.0314437 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1152099e-10 4.518586e-11 2.9364072e-10 ] [ 7.183959e-11 2.5839196e-10 1.9496404e-10 ] [ 2.6628932e-10 2.273294e-11 1.1388779e-10 ] [ 3.0890439e-10 2.4963366e-10 1.7278177e-10 ] [ 8.676801e-11 1.2686776e-10 -3.14437e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.9e-06 6.2e-06 -4e-06 ] [ 3e-06 -5e-06 1.08e-05 ] [ -3.5e-06 3.6e-06 6e-07 ] [ -5e-07 4e-07 -2.8e-06 ] [ 3.9e-06 -5.1e-06 -4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.6463122386e-15 9.9334951308e-15 -6.408706535999999e-15 ] [ 4.806529901999999e-15 -8.010883169999999e-15 1.73035076472e-14 ] [ -5.607618218999999e-15 5.767835882399999e-15 9.613059803999998e-16 ] [ -8.010883169999999e-16 6.408706536e-16 -4.486094575199999e-15 ] [ 6.248488872599999e-15 -8.1711008334e-15 -7.530230179799999e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }