{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.87488 -10.3426567 3.3918418 ] [ -4.1104663 4.6782923 -5.3152732 ] [ 2.8010545 -5.5782664 -1.0255432 ] [ 6.3493457 5.5903509 -4.2698067 ] [ -3.6764086 -0.5450326 -3.7773418 ] [ 3.5868635 -5.4535329 5.5846224 ] [ 2.9244911 11.6508454 5.4115006 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.261694873155392e-08 -1.657076289822355e-08 5.434329678184501e-09 ] [ -6.585693060704433e-09 7.495450610082117e-09 -8.516006524366409e-09 ] [ 4.487784070460552e-09 -8.937368084307298e-09 -1.643101352197589e-09 ] [ 1.017277332172837e-08 8.956729587840869e-09 -6.840984526436648e-09 ] [ -5.890255955956651e-09 -8.732384964882683e-10 -6.0519687705915e-09 ] [ 5.746788889047459e-09 -8.737522985130258e-09 8.947551518993e-09 ] [ 4.685551306760957e-09 1.866671226622638e-08 8.67017981619698e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4876519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.52008941857057e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2291633 1.7361923 4.9759957 ] [ 2.1041268 3.2282077 1.4221994 ] [ 4.3884672 -0.0698573 1.5825417 ] [ 5.4473735 3.1571882 2.6021611 ] [ 4.3009919 2.2680149 0.6452462 ] [ 5.266478 0.9875858 3.6950631 ] [ 3.3060833 3.817944 3.557466 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2291633e-10 1.7361923e-10 4.975995700000001e-10 ] [ 2.1041268e-10 3.2282077e-10 1.4221994e-10 ] [ 4.3884672e-10 -6.98573e-12 1.5825417e-10 ] [ 5.4473735e-10 3.1571882e-10 2.6021611e-10 ] [ 4.3009919e-10 2.2680149e-10 6.452462e-11 ] [ 5.266478000000001e-10 9.875858e-11 3.6950631e-10 ] [ 3.3060833e-10 3.817944e-10 3.557466e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-06 -2.47e-05 -9.5e-06 ] [ -9.8e-06 -8.3e-06 7.8e-06 ] [ -1.65e-05 -3.75e-05 -3e-07 ] [ 5.33e-05 1.54e-05 -3.7e-06 ] [ -1.87e-05 4.22e-05 4.66e-05 ] [ -5e-07 1.7e-05 8.8e-06 ] [ -8e-07 -4.1e-06 -4.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.1215236438e-14 -3.95737628598e-14 -1.5220678023e-14 ] [ -1.57013310132e-14 -1.32980660622e-14 1.24969777452e-14 ] [ -2.6435914461e-14 -6.008162377499999e-14 -4.806529901999999e-16 ] [ 8.53960145922e-14 2.46735201636e-14 -5.9280535458e-15 ] [ -2.99607030558e-14 6.761185395480001e-14 7.466143114439999e-14 ] [ -8.010883169999999e-16 2.723700277799999e-14 1.40991543792e-14 ] [ -1.2817413072e-15 -6.568924199399999e-15 -7.96281787098e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.894908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.347733336717967e-18 } }