{ "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" [ [ -118.748259 49.2336438 228.1232329 ] [ -28.6997778 -11.5304289 -0.9718408 ] [ 1262.8239802 767.9457256 112.9996333 ] [ -1120.0103597 -831.7696603 -341.5158953 ] [ 155.9473518 -66.6566446 -639.6522719 ] [ -151.3129355 92.7773644 641.0171417 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.902556843305032e-07 7.888099305315488e-08 3.654937104136934e-07 ] [ -4.598211301331486e-08 -1.847378361137666e-08 -1.557060608899569e-09 ] [ 2.023267057262042e-06 1.230384687599612e-06 1.810453706322332e-07 ] [ -1.794454413365138e-06 -1.332641903623418e-06 -5.471687830812406e-07 ] [ 2.498552011296328e-07 -1.067957175990946e-07 -1.024835915479785e-06 ] [ -2.424300476827184e-07 1.486457241811222e-07 1.027022677963781e-06 ] ] } "unrelaxed-potential-energy" { "source-value" 454.33507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.279250271635314e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.1031818 0.2294044 1.9636382 ] [ 0.3693175 2.701591 1.8094315 ] [ 3.5143844 0.657748 0.0819628 ] [ 1.8177714 -1.004916 0.908714 ] [ 2.670619 2.9740871 0.6124082 ] [ 2.4736339 3.4155736 3.1758798 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.031818e-11 2.294044e-11 1.9636382e-10 ] [ 3.693175e-11 2.701591e-10 1.8094315e-10 ] [ 3.5143844e-10 6.57748e-11 8.196280000000001e-12 ] [ 1.8177714e-10 -1.004916e-10 9.08714e-11 ] [ 2.670619e-10 2.974087100000001e-10 6.124082e-11 ] [ 2.4736339e-10 3.4155736e-10 3.1758798e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.03e-05 1.24e-05 1.35e-05 ] [ -1.61e-05 2.54e-05 -1.47e-05 ] [ 4.94e-05 2.87e-05 -1.92e-05 ] [ -1.85e-05 -7.27e-05 1.46e-05 ] [ -1.6e-05 2.57e-05 -1.04e-05 ] [ 1.15e-05 -1.96e-05 1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.650241919424e-14 1.986699009792e-14 2.16293843808e-14 ] [ -2.579504359488e-14 4.069528616832e-14 -2.355199632576e-14 ] [ 7.914752506752001e-14 4.598246901696e-14 -3.076179111936e-14 ] [ -2.96402674848e-14 -1.1647824033216e-13 2.339177866368e-14 ] [ -2.56348259328e-14 4.117593915456e-14 -1.666263685632e-14 ] [ 1.84250311392e-14 -3.140266176767999e-14 2.579504359488e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.53523 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.129888878795079e-18 } }