{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5865375 -7.9347407 -5.4686587 ] [ 0.2826491 -0.2486735 1.1145864 ] [ -5.7438374 -0.3333806 -4.6446124 ] [ -5.5863825 -2.8749318 11.0580912 ] [ 0.6182992 11.7663716 -1.6715609 ] [ 2.9938689 2.1788846 -4.7993343 ] [ 9.0219402 -2.5535296 4.4114887 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.54191329052248e-09 -1.271285604165023e-08 -8.761757116274522e-09 ] [ 4.528537799101613e-10 -3.984188679125088e-10 1.785764271941637e-09 ] [ -9.20264199595666e-09 -5.341346031482765e-10 -7.441489399957777e-09 ] [ -8.950371436346257e-09 -4.606148516354462e-09 1.771701519131422e-08 ] [ 9.906245228993434e-10 1.885180548916509e-08 -2.678135794223406e-09 ] [ 4.796706757320212e-09 3.49095796554116e-09 -7.689381210863533e-09 ] [ 1.445474166269568e-08 -4.091205425640776e-09 7.067984058063385e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.90453 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227751288921222e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5284251 0.6448787 2.7016356 ] [ 2.853581 2.3412335 0.893875 ] [ 0.985826 2.8196411 2.4857149 ] [ 2.2946877 2.3292765 4.7665511 ] [ 2.5576959 4.4736012 3.5079547 ] [ 4.4381991 3.598984 2.2407564 ] [ 4.5105383 1.720518 3.781266 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5284251e-10 6.448787e-11 2.7016356e-10 ] [ 2.853581e-10 2.3412335e-10 8.93875e-11 ] [ 9.85826e-11 2.8196411e-10 2.4857149e-10 ] [ 2.2946877e-10 2.3292765e-10 4.7665511e-10 ] [ 2.5576959e-10 4.4736012e-10 3.5079547e-10 ] [ 4.4381991e-10 3.598984e-10 2.2407564e-10 ] [ 4.510538300000001e-10 1.720518e-10 3.781266e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.2e-06 -5e-07 -3.7e-06 ] [ 6.4e-06 9e-06 6e-07 ] [ -1.31e-05 -9.7e-06 -3e-07 ] [ 2.8e-06 1.48e-05 1e-07 ] [ 6.9e-06 2e-07 -1.4e-06 ] [ -9.4e-06 -1.15e-05 1.02e-05 ] [ 2.3e-06 -2.2e-06 -5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.72914180736e-15 -8.010883104e-16 -5.928053496960001e-15 ] [ 1.025393037312e-14 1.44195895872e-14 9.6130597248e-16 ] [ -2.098851373248e-14 -1.554111322176e-14 -4.8065298624e-16 ] [ 4.48609453824e-15 2.371221398784e-14 1.6021766208e-16 ] [ 1.105501868352e-14 3.2043532416e-16 -2.24304726912e-15 ] [ -1.506046023552e-14 -1.84250311392e-14 1.634220153216e-14 ] [ 3.68500622784e-15 -3.52478856576e-15 -8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }