{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.992977 1.520628 1.322916 ] [ 2.351443 2.977576 3.35114 ] [ 0.8368319 3.514349 1.69894 ] [ 2.887807 3.844369 0.5466762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992977e-10 1.520628e-10 1.322916e-10 ] [ 2.351443e-10 2.977576e-10 3.35114e-10 ] [ 8.368319e-11 3.514349e-10 1.69894e-10 ] [ 2.887807e-10 3.844369e-10 5.466762e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1920163 -6.7627961 -2.1367431 ] [ 2.5124135 0.4143589 6.6031521 ] [ -5.8887681 3.1740185 -0.9942979 ] [ 3.1843383 3.1744186 -3.472111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.076440292071342e-10 -1.083519389192633e-08 -3.423439867680725e-09 ] [ 4.025330204646158e-09 6.638761476699424e-10 1.057941600536803e-08 ] [ -9.434846652864576e-09 5.085338276583729e-09 -1.593040862615268e-09 ] [ 5.101872419011281e-09 5.085979307454992e-09 -5.562935114854374e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7052538 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.140824329399709e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6173765 0.9024844 1.0507026 ] [ 2.2893033 3.3279751 3.8899471 ] [ 1.2528885 3.2363322 1.6783638 ] [ 2.9094906 4.3901303 0.3006586 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6173765e-10 9.024844e-11 1.0507026e-10 ] [ 2.2893033e-10 3.327975100000001e-10 3.8899471e-10 ] [ 1.2528885e-10 3.2363322e-10 1.6783638e-10 ] [ 2.9094906e-10 4.3901303e-10 3.006586e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 3.3e-06 9e-07 ] [ -7e-07 -2e-07 -1.5e-06 ] [ -1.7e-06 -4.9e-06 2.9e-06 ] [ 2.7e-06 1.8e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706536e-16 5.2871828922e-15 1.4419589706e-15 ] [ -1.1215236438e-15 -3.204353268e-16 -2.403264951e-15 ] [ -2.7237002778e-15 -7.850665506599998e-15 4.6463122386e-15 ] [ 4.3258769118e-15 2.8839179412e-15 -3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.1471636 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.465537178729532e-18 } }