{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2194908 -1.6262658 -0.525062 ] [ -3.1046362 -0.8883245 3.0402759 ] [ -3.6648537 0.8186595 -2.3928319 ] [ 0.3681463 2.9534282 0.5197193 ] [ 0.8807863 -1.7746884 -4.8774454 ] [ 3.8062257 -1.5981515 4.0719499 ] [ 3.9338223 2.1153425 0.1633942 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.556016269840689e-09 -2.605565043966609e-09 -8.412420608704897e-10 ] [ -4.974175535729354e-09 -1.42325274558385e-09 4.871058967761679e-09 ] [ -5.871742916792376e-09 1.311637111295817e-09 -3.833739327684444e-09 ] [ 5.89835394894023e-10 4.731913613251426e-09 8.326821118385414e-10 ] [ 1.411175217780935e-09 -2.843364263684959e-09 -7.814528989108504e-09 ] [ 6.098245830028115e-09 -2.560520969796451e-09 6.523982930848897e-09 ] [ 6.302678119441684e-09 3.389152298484624e-09 2.617863672143194e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.366328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.942610133154442e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8534532 1.6527781 2.4596137 ] [ 2.0070935 2.1254721 4.7580547 ] [ 1.9588494 3.968703 2.0655841 ] [ 3.2728252 4.1040763 4.1123016 ] [ 4.2167752 1.520426 2.3266647 ] [ 4.3746528 1.9928775 4.6248688 ] [ 4.3264037 3.836109 1.9323693 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8534532e-10 1.6527781e-10 2.4596137e-10 ] [ 2.0070935e-10 2.1254721e-10 4.7580547e-10 ] [ 1.9588494e-10 3.968703e-10 2.0655841e-10 ] [ 3.2728252e-10 4.1040763e-10 4.1123016e-10 ] [ 4.2167752e-10 1.520426e-10 2.3266647e-10 ] [ 4.3746528e-10 1.9928775e-10 4.6248688e-10 ] [ 4.3264037e-10 3.836109e-10 1.9323693e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 1.1e-05 1.45e-05 ] [ 2.57e-05 9.8e-06 3.9e-06 ] [ -2.92e-05 -4.8e-06 -3.92e-05 ] [ -1.59e-05 2.2e-06 1.39e-05 ] [ -4e-06 -2.9e-06 -4.1e-06 ] [ 5e-07 -1.82e-05 -9.6e-06 ] [ 2.41e-05 3e-06 2.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 1.76239428288e-14 2.32315610016e-14 ] [ 4.117593915456e-14 1.570133088384e-14 6.24848882112e-15 ] [ -4.678355732736e-14 -7.69044777984e-15 -6.280532353535999e-14 ] [ -2.547460827072e-14 3.52478856576e-15 2.227025502912e-14 ] [ -6.4087064832e-15 -4.646312200320001e-15 -6.568924145279999e-15 ] [ 8.010883104e-16 -2.915961449856e-14 -1.538089555968e-14 ] [ 3.861245656128e-14 4.8065298624e-15 3.300483838848e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.906032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669950894569667e-18 } }