{ "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" [ [ 0.7481215 0.3697243 2.264709 ] [ 0.2413431 2.204484 1.035234 ] [ 2.632044 0.6504598 2.339521 ] [ 2.588426 1.874203 0.0457334 ] [ 2.842468 2.848588 2.160611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481215e-11 3.697243e-11 2.264709e-10 ] [ 2.413431e-11 2.204484e-10 1.035234e-10 ] [ 2.632044e-10 6.504598e-11 2.339521e-10 ] [ 2.588426e-10 1.874203e-10 4.57334e-12 ] [ 2.842468e-10 2.848588e-10 2.160611e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3938796 -1.3554242 0.1711981 ] [ 1.3116078 0.6285424 -0.6415109 ] [ 5.5489371 -0.406703 -0.0889612 ] [ -1.0450804 -0.2264406 0.6431588 ] [ -0.4215849 1.3600253 -0.0838848 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.641947790530056e-09 -2.171628964506543e-09 2.742895933453805e-10 ] [ 2.101427352818922e-09 1.007035938461522e-09 -1.027813765968367e-09 ] [ 8.890377291909752e-09 -6.516100382092224e-10 -1.42531554798313e-10 ] [ -1.674403383736312e-09 -3.627978353199245e-10 1.030453992821783e-09 ] [ -6.754534704623059e-10 2.179000739356506e-09 -1.343982654004838e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -14.350443 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.299194427272302e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7348562 0.2553838 1.7647261 ] [ 0.419491 2.5779406 1.3178938 ] [ 2.9646725 0.6976733 2.4897694 ] [ 2.2840568 1.3962412 0.2305408 ] [ 2.6493262 3.0202202 2.0428783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.348562e-11 2.553838e-11 1.7647261e-10 ] [ 4.19491e-11 2.5779406e-10 1.3178938e-10 ] [ 2.9646725e-10 6.976733e-11 2.4897694e-10 ] [ 2.2840568e-10 1.3962412e-10 2.305408e-11 ] [ 2.6493262e-10 3.0202202e-10 2.0428783e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-05 2.05e-05 9.4e-06 ] [ 3.4e-06 -8.4e-06 -1.35e-05 ] [ -4e-06 -9e-06 -1.19e-05 ] [ -8.2e-06 -1e-06 5.9e-06 ] [ -7.2e-06 -2.2e-06 1.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.56348259328e-14 3.28446207264e-14 1.506046023552e-14 ] [ 5.44740051072e-15 -1.345828361472e-14 -2.16293843808e-14 ] [ -6.4087064832e-15 -1.44195895872e-14 -1.906590178752e-14 ] [ -1.313784829056e-14 -1.6021766208e-15 9.45284206272e-15 ] [ -1.153567166976e-14 -3.52478856576e-15 1.618198387008e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }