{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.803246 -4.9479767 -11.0384768 ] [ -6.500745 3.3956619 -1.8881661 ] [ -3.3464488 -5.1803123 8.7681819 ] [ -3.9009081 8.377672 -3.8040611 ] [ 3.5743375 -0.9233224 1.4529064 ] [ 6.1691336 1.182669 0.042821 ] [ 3.2013848 -1.9043915 6.4667947 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.286941961951117e-09 -7.927532589003135e-09 -1.76855894582032e-08 ] [ -1.04153416567825e-08 5.440450108321308e-09 -3.025175581607115e-09 ] [ -5.361602030064215e-09 -8.299775255502675e-09 1.404817604710172e-08 ] [ -6.249943757709349e-09 1.342251021513078e-08 -6.094777758514731e-09 ] [ 5.72671997734872e-09 -1.479325562740946e-09 2.327812666290693e-09 ] [ 9.88404162451174e-09 1.894844621944915e-09 6.860680507927679e-11 ] [ 5.129183880744483e-09 -3.051171538150244e-09 1.036094727985335e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.925493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.871980580091405e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6685168 1.8191793 1.0203256 ] [ 0.4075693 2.6871157 1.6491261 ] [ 1.682712 1.794198 3.608027 ] [ 2.2631382 4.2026501 2.3706475 ] [ 4.0888573 1.0481305 3.035716 ] [ 4.6226757 3.2631866 1.8977018 ] [ 3.7160306 3.2402089 4.27761 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6685168e-10 1.8191793e-10 1.0203256e-10 ] [ 4.075693e-11 2.6871157e-10 1.6491261e-10 ] [ 1.682712e-10 1.794198e-10 3.608027e-10 ] [ 2.2631382e-10 4.2026501e-10 2.3706475e-10 ] [ 4.0888573e-10 1.0481305e-10 3.035716e-10 ] [ 4.6226757e-10 3.2631866e-10 1.8977018e-10 ] [ 3.7160306e-10 3.2402089e-10 4.27761e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.79e-05 5.3e-06 1.6e-06 ] [ 3.4e-05 -9.7e-06 1.1e-05 ] [ -6.9e-06 1.9e-06 -1.66e-05 ] [ 4.7e-06 -1.13e-05 8.2e-06 ] [ -7.4e-06 3.38e-05 0.0 ] [ -8.9e-06 -1.57e-05 1.25e-05 ] [ 2.5e-06 -4.3e-06 -1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.867896151232001e-14 8.491536090240001e-15 2.56348259328e-15 ] [ 5.44740051072e-14 -1.554111322176e-14 1.76239428288e-14 ] [ -1.105501868352e-14 3.04413557952e-15 -2.659613190528e-14 ] [ 7.53023011776e-15 -1.810459581504e-14 1.313784829056e-14 ] [ -1.185610699392e-14 5.415356978304e-14 0.0 ] [ -1.425937192512e-14 -2.515417294656e-14 2.002720776e-14 ] [ 4.005441552e-15 -6.889359469440001e-15 -2.675634956736e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }