{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6126613 4.7225556 -32.3172293 ] [ -2.3605924 -7.8106838 34.435988 ] [ -16.6046759 13.6133471 -23.7895731 ] [ -2.3149017 -12.2376722 -12.4080372 ] [ 6.6567135 2.0726744 -14.5119343 ] [ 6.4146422 0.1714796 17.6853908 ] [ 12.8214756 -0.5317008 30.905395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.390298094528935e-09 7.566368172748116e-09 -5.177790923349275e-08 ] [ -3.782085954518162e-09 -1.25140949768213e-08 5.517253488774936e-08 ] [ -2.66036235229412e-08 2.181098645445548e-08 -3.811509783963258e-08 ] [ -3.708881383190176e-09 -1.96069122918541e-08 -1.98798671118567e-08 ] [ 1.066523074106374e-08 3.320790466210667e-09 -2.325068185804561e-08 ] [ 1.027738976363708e-08 2.747406060641357e-10 2.833511966947141e-08 ] [ 2.054226845047765e-08 -8.518785910206566e-10 4.951590132558922e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.590093 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.696719941669774e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4411769 1.547063 1.5455602 ] [ 1.8258214 1.9122679 4.1232745 ] [ 2.5335688 3.8165095 2.2238218 ] [ 3.3991982 -0.0695432 1.578989 ] [ 5.109603 3.3144578 2.3631901 ] [ 4.3170653 1.1592213 3.6159134 ] [ 3.7596514 3.6858401 4.683123 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4411769e-10 1.547063e-10 1.5455602e-10 ] [ 1.8258214e-10 1.9122679e-10 4.1232745e-10 ] [ 2.5335688e-10 3.8165095e-10 2.2238218e-10 ] [ 3.3991982e-10 -6.95432e-12 1.578989e-10 ] [ 5.109603000000001e-10 3.3144578e-10 2.3631901e-10 ] [ 4.317065300000001e-10 1.1592213e-10 3.6159134e-10 ] [ 3.7596514e-10 3.6858401e-10 4.683123e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-06 -1.86e-05 5.65e-05 ] [ 3.62e-05 -6.1e-06 -7.48e-05 ] [ -1.16e-05 1.37e-05 -6.9e-06 ] [ 6.4e-06 -2.71e-05 -2.48e-05 ] [ 1.83e-05 2.03e-05 -9e-07 ] [ -6.69e-05 2.9e-05 2.77e-05 ] [ 2.65e-05 -1.11e-05 2.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-14 -2.980048514688e-14 9.052297907519999e-14 ] [ 5.799879367296e-14 -9.77327738688e-15 -1.1984281123584e-13 ] [ -1.858524880128e-14 2.194981970496e-14 -1.105501868352e-14 ] [ 1.025393037312e-14 -4.341898642368e-14 -3.973398019584e-14 ] [ 2.931983216064e-14 3.252418540224e-14 -1.44195895872e-15 ] [ -1.0718561593152e-13 4.64631220032e-14 4.438029239616e-14 ] [ 4.24576804512e-14 -1.778416049088e-14 3.701027994048e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.420024 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.912519153217491e-18 } }