{ "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" [ [ 1.569029 2.409456 2.459016 ] [ 1.280031 0.1374919 2.779238 ] [ 3.588101 1.133333 2.932926 ] [ 4.931515 2.722575 2.426382 ] [ 3.330231 3.38172 3.93095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.569029e-10 2.409456e-10 2.459016e-10 ] [ 1.280031e-10 1.374919e-11 2.779238e-10 ] [ 3.588101e-10 1.133333e-10 2.932926e-10 ] [ 4.931515000000001e-10 2.722575e-10 2.426382e-10 ] [ 3.330231e-10 3.38172e-10 3.93095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1536858 0.8170601 0.0872848 ] [ 0.2883491 0.0132694 0.004366 ] [ -0.8531102 -2.4021855 0.5958481 ] [ 1.1793327 1.3373902 -0.9194161 ] [ -0.7682574 0.2344658 0.2319172 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.462317977375972e-10 1.309074600793703e-09 1.398456670633632e-10 ] [ 4.619861904549294e-10 2.12599226271996e-11 6.995103184043999e-12 ] [ -1.366833228667067e-09 -3.848725478633606e-09 9.546539032332954e-10 ] [ 1.889499295652131e-09 2.142735328980586e-09 -1.473066992343407e-09 ] [ -1.230884055177592e-09 3.756556262321171e-10 3.715723188627047e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.293474432689672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.64919642187318e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.895817 2.9749297 2.2959769 ] [ 1.7798724 0.6241556 2.6664741 ] [ 3.9837479 0.9389018 3.5154266 ] [ 4.0984503 2.3726212 1.6159186 ] [ 2.9410194 2.8739676 4.4347158 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.895817e-10 2.9749297e-10 2.2959769e-10 ] [ 1.7798724e-10 6.241556000000001e-11 2.6664741e-10 ] [ 3.9837479e-10 9.389018e-11 3.5154266e-10 ] [ 4.0984503e-10 2.372621200000001e-10 1.6159186e-10 ] [ 2.9410194e-10 2.8739676e-10 4.4347158e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -3.7e-06 -2.2e-06 ] [ 3.4e-06 -2.2e-06 -2.2e-06 ] [ -1.3e-05 5e-07 1.23e-05 ] [ -3.2e-06 1.06e-05 -1.2e-06 ] [ 1.34e-05 -5.2e-06 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999998e-16 -5.9280535458e-15 -3.5247885948e-15 ] [ 5.4474005556e-15 -3.5247885948e-15 -3.5247885948e-15 ] [ -2.082829624199999e-14 8.010883169999999e-16 1.97067725982e-14 ] [ -5.1269652288e-15 1.69830723204e-14 -1.9226119608e-15 ] [ 2.14691668956e-14 -8.331318496799998e-15 -1.07345834478e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }