{ "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" [ [ 2.285903 1.887977 1.671083 ] [ 2.68762 1.716714 3.675724 ] [ 2.821512 3.759774 2.999624 ] [ 4.480266 2.258259 2.346621 ] [ 5.253697 4.060686 3.32016 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.285903e-10 1.887977e-10 1.671083e-10 ] [ 2.68762e-10 1.716714e-10 3.675724e-10 ] [ 2.821512e-10 3.759774e-10 2.999624e-10 ] [ 4.480266000000001e-10 2.258259e-10 2.346621e-10 ] [ 5.253697e-10 4.060686e-10 3.32016e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0318829 -0.5199467 -4.2819063 ] [ -0.3289829 -2.5043173 4.6828506 ] [ 0.3243855 3.6869353 0.4539359 ] [ 2.6796686 -1.6242449 -1.2073646 ] [ -0.6431882 0.9615737 0.3524844 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.255435305404158e-09 -8.330464536654077e-10 -6.860370222837393e-09 ] [ -5.270887153655586e-10 -4.012358662181967e-09 7.50275381183288e-09 ] [ 5.197228685084069e-10 5.907121588729779e-09 7.272854923137605e-10 ] [ 4.293302417783492e-09 -2.602327226673667e-09 -1.934411350838756e-09 ] [ -1.030501105304519e-09 1.540610914008926e-09 5.647422695295095e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.826106932689672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.41409822967408e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6750224 2.5396868 1.2374364 ] [ 3.0257176 1.7370477 4.1987514 ] [ 2.4496411 3.8339592 3.2251261 ] [ 4.5619581 1.6394048 2.3801587 ] [ 4.8166588 3.9333115 2.9717394 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6750224e-10 2.5396868e-10 1.2374364e-10 ] [ 3.0257176e-10 1.7370477e-10 4.1987514e-10 ] [ 2.4496411e-10 3.8339592e-10 3.225126100000001e-10 ] [ 4.5619581e-10 1.6394048e-10 2.3801587e-10 ] [ 4.8166588e-10 3.9333115e-10 2.9717394e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 1e-07 2.5e-06 ] [ 1e-06 1.7e-06 -2.8e-06 ] [ 1.1e-06 -1.6e-06 -5e-07 ] [ -1.8e-06 1.2e-06 8e-07 ] [ -1.4e-06 -1.4e-06 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7623942974e-15 1.602176634e-16 4.005441585e-15 ] [ 1.602176634e-15 2.7237002778e-15 -4.486094575199999e-15 ] [ 1.7623942974e-15 -2.5634826144e-15 -8.010883169999999e-16 ] [ -2.8839179412e-15 1.9226119608e-15 1.2817413072e-15 ] [ -2.2430472876e-15 -2.2430472876e-15 0.0 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }