{ "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" [ [ 0.6874791 0.1657934 2.219954 ] [ 0.5100092 2.362694 1.535272 ] [ 2.868635 0.820347 0.8272379 ] [ 1.615801 0.0071538 0.7495484 ] [ 2.741884 2.697599 0.8166341 ] [ 2.318736 2.919901 2.403388 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.874791e-11 1.657934e-11 2.219954e-10 ] [ 5.100092000000001e-11 2.362694e-10 1.535272e-10 ] [ 2.868635e-10 8.203470000000001e-11 8.272379e-11 ] [ 1.615801e-10 7.1538e-13 7.495484e-11 ] [ 2.741884e-10 2.697599e-10 8.166341000000001e-11 ] [ 2.318736e-10 2.919901e-10 2.403388e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.4408416 -6.2700806 8.7463576 ] [ -25.5173504 -1.5512627 1.9849057 ] [ 18.7035476 -3.8778402 -10.7393921 ] [ -3.8536631 -1.4366671 -1.5454955 ] [ 17.9709691 4.1995354 -11.0935112 ] [ 4.1373384 8.9363151 12.6471355 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.833024908481517e-08 -1.00457766306167e-08 1.401320977932831e-08 ] [ -4.088330257247055e-08 -2.485396851135752e-09 3.180169533233413e-09 ] [ 2.996638693762678e-08 -6.212984958825886e-09 -1.720640308598419e-08 ] [ -6.174248974128004e-09 -2.301794458456541e-09 -2.476156778052147e-09 ] [ 2.879266678235601e-08 6.728397491535843e-09 -1.77737644336573e-08 ] [ 6.628746911430945e-09 1.431755524728137e-08 2.02629449851319e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.4573708 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.937142076833887e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0115264 -0.1751427 2.5046001 ] [ 0.3372375 2.1461028 1.8970545 ] [ 3.6177062 0.7240105 0.7982975 ] [ 1.3858216 0.1443784 0.5490237 ] [ 3.0997817 2.9205248 0.3279857 ] [ 2.3135238 3.2136144 2.4750729 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.15264e-12 -1.751427e-11 2.5046001e-10 ] [ 3.372375e-11 2.1461028e-10 1.8970545e-10 ] [ 3.617706200000001e-10 7.240105e-11 7.982975000000001e-11 ] [ 1.3858216e-10 1.443784e-11 5.490237e-11 ] [ 3.0997817e-10 2.9205248e-10 3.279857e-11 ] [ 2.3135238e-10 3.2136144e-10 2.4750729e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.85e-05 -0.0001103 0.0001051 ] [ 7.6e-06 9.59e-05 4.73e-05 ] [ -1.39e-05 3.27e-05 7.41e-05 ] [ 3.46e-05 -1.78e-05 -0.0002038 ] [ -2e-07 -5.24e-05 4.2e-06 ] [ 2.04e-05 5.19e-05 -2.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.770556674899999e-14 -1.767200827302e-13 1.683887642334e-13 ] [ 1.21765424184e-14 1.536487392006e-13 7.578295478819998e-14 ] [ -2.22702552126e-14 5.23911759318e-14 1.187212885794e-13 ] [ 5.54353115364e-14 -2.851874408519999e-14 -3.265235980092e-13 ] [ -3.204353268e-16 -8.395405562159998e-14 6.729141862799999e-15 ] [ 3.26844033336e-14 8.315296730459999e-14 -4.309855145459999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.533065 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.969324369940321e-18 } }