{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 18.0736572 18.1222175 -79.2593625 ] [ -28.2796644 -34.0823955 74.9479547 ] [ -6.497662 5.2472361 -93.0332526 ] [ 107.1452266 -23.4244441 61.8689265 ] [ -90.4415574 34.1373859 35.475734 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.895719101819359e-08 2.903499319555263e-08 -1.269874975770122e-07 ] [ -4.530901714575007e-08 -5.460601725095913e-08 1.200798607971175e-07 ] [ -1.041040214626057e-08 8.406999003237772e-09 -1.490557022727008e-07 ] [ 1.716655770888383e-07 -3.753009669225649e-08 9.912494759229357e-08 ] [ -1.449033488150212e-07 5.469412158420756e-08 5.683839162051967e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 55.982808 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.96943461443352e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.883984 0.5974561 0.5543794 ] [ 0.140648 0.9154133 2.674678 ] [ 2.7144388 1.9035787 0.2497661 ] [ 3.1023858 3.0287632 2.1818041 ] [ 1.5116924 2.4180473 3.6804814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.839840000000001e-11 5.974561000000001e-11 5.543794e-11 ] [ 1.40648e-11 9.154133000000001e-11 2.674678e-10 ] [ 2.7144388e-10 1.9035787e-10 2.497661e-11 ] [ 3.1023858e-10 3.0287632e-10 2.1818041e-10 ] [ 1.5116924e-10 2.4180473e-10 3.6804814e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 -4e-07 4e-07 ] [ -4.7e-06 -6e-07 4.7e-06 ] [ 2.6e-06 4e-06 5.7e-06 ] [ -1.6e-06 -4e-07 -8e-07 ] [ 3.9e-06 -2.6e-06 -1.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-16 -6.408706483200001e-16 6.408706483200001e-16 ] [ -7.53023011776e-15 -9.6130597248e-16 7.53023011776e-15 ] [ 4.16565921408e-15 6.4087064832e-15 9.13240673856e-15 ] [ -2.56348259328e-15 -6.408706483200001e-16 -1.28174129664e-15 ] [ 6.24848882112e-15 -4.16565921408e-15 -1.618198387008e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.066442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.41391011310392e-18 } }