{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.797173 1.880519 2.621604 ] [ 2.732492 2.231734 4.550403 ] [ 1.229923 3.945183 3.396256 ] [ 3.798537 2.960677 2.455754 ] [ 3.373455 4.934702 3.584472 ] [ 4.913806 3.358248 4.34106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.797173e-10 1.880519e-10 2.621604e-10 ] [ 2.732492e-10 2.231734e-10 4.550403000000001e-10 ] [ 1.229923e-10 3.945183e-10 3.396256e-10 ] [ 3.798537e-10 2.960677e-10 2.455754e-10 ] [ 3.373455e-10 4.934702e-10 3.584472e-10 ] [ 4.913806e-10 3.358248e-10 4.34106e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5800973 -2.4173799 -3.7143208 ] [ 0.9697346 -0.7769658 4.514079 ] [ -2.7898843 1.9499845 1.8840477 ] [ 3.4638768 -1.7980935 -5.1939373 ] [ -0.5586037 3.3925395 -0.3803372 ] [ 1.4949738 -0.3500848 2.8904686 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.133771573449204e-09 -3.873069559371841e-09 -5.950997947911153e-09 ] [ 1.55368610450084e-09 -1.244836439921169e-09 7.232351838244243e-09 ] [ -4.469887400196973e-09 3.124219576822377e-09 3.018577177412012e-09 ] [ 5.549742426291518e-09 -2.880863367712445e-09 -8.321604911961076e-09 ] [ -8.94981788432377e-10 5.435447472040521e-09 -6.093673698605337e-10 ] [ 2.395212071068535e-09 -5.608976818574438e-10 4.631041214076507e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.13284 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.584765907510708e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0203045 1.9730723 2.560993 ] [ 2.5377711 2.1634767 4.9140884 ] [ 1.3222706 3.9288739 3.7973922 ] [ 4.0485368 3.0331438 2.029196 ] [ 3.350502 4.9889407 3.2655837 ] [ 4.566001 3.2235556 4.3822957 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0203045e-10 1.9730723e-10 2.560993e-10 ] [ 2.5377711e-10 2.1634767e-10 4.9140884e-10 ] [ 1.3222706e-10 3.9288739e-10 3.7973922e-10 ] [ 4.0485368e-10 3.0331438e-10 2.029196e-10 ] [ 3.350502e-10 4.9889407e-10 3.2655837e-10 ] [ 4.566001e-10 3.2235556e-10 4.3822957e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 2.76e-05 3.76e-05 ] [ -4.9e-06 1.3e-05 -1.62e-05 ] [ 2.15e-05 -3.42e-05 -1.99e-05 ] [ 1.24e-05 -2.41e-05 2.17e-05 ] [ -1.73e-05 3.82e-05 2.19e-05 ] [ -1.77e-05 -2.06e-05 -4.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 4.422007473408001e-14 6.024184094208e-14 ] [ -7.850665441919999e-15 2.08282960704e-14 -2.595526125696e-14 ] [ 3.44467973472e-14 -5.479444043136e-14 -3.188331475392e-14 ] [ 1.986699009792e-14 -3.861245656128e-14 3.476723267136e-14 ] [ -2.771765553984e-14 6.120314691456e-14 3.508766799552e-14 ] [ -2.835852618816e-14 -3.300483838848e-14 -7.209794793600001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.482382 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961204033709475e-18 } }