{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.4943008 -15.7124276 -14.6536737 ] [ -11.2866906 -30.7802108 1.9056408 ] [ -19.7544282 27.4099336 10.89227 ] [ 16.3045296 3.9950444 -50.7791119 ] [ 20.1900374 -46.5516828 30.2918144 ] [ 10.0408527 61.6393431 22.3430604 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.482460649740274e-08 -2.517408415673266e-08 -2.347777341097183e-08 ] [ -1.808327180552312e-08 -4.931533412705567e-08 3.053173137402609e-09 ] [ -3.165008301931223e-08 4.391555479160038e-08 1.745134034144122e-08 ] [ 2.612273613826158e-08 6.400766736737964e-09 -8.135710591116705e-08 ] [ 3.234800589535762e-08 -7.458401784105748e-08 4.853283683329278e-08 ] [ 1.608721944883656e-08 9.87571144362898e-08 3.579752901000229e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 21.830886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.497693516055003e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8289462 -0.0078006 0.1114129 ] [ 0.4190456 -0.1387325 2.3806367 ] [ 0.1296829 2.0933847 2.8987799 ] [ 2.7680198 1.1577594 0.4647817 ] [ 2.7134732 0.1505629 2.73818 ] [ 2.2980762 2.569867 2.3380325 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.289462e-11 -7.800600000000001e-13 1.114129e-11 ] [ 4.190456e-11 -1.387325e-11 2.3806367e-10 ] [ 1.296829e-11 2.0933847e-10 2.8987799e-10 ] [ 2.7680198e-10 1.1577594e-10 4.647817e-11 ] [ 2.7134732e-10 1.505629e-11 2.73818e-10 ] [ 2.2980762e-10 2.569867e-10 2.3380325e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.6e-06 1.4e-06 7.5e-06 ] [ 1.7e-06 1.35e-05 2.11e-05 ] [ -2.98e-05 -8.9e-06 -1.05e-05 ] [ -1.3e-06 8.3e-06 8.1e-06 ] [ 2.1e-06 -2.77e-05 -2.02e-05 ] [ 1.88e-05 1.34e-05 -6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.377871893888e-14 2.24304726912e-15 1.2016324656e-14 ] [ 2.72370025536e-15 2.16293843808e-14 3.380592669888e-14 ] [ -4.774486329984001e-14 -1.425937192512e-14 -1.68228545184e-14 ] [ -2.08282960704e-15 1.329806595264e-14 1.297763062848e-14 ] [ 3.36457090368e-15 -4.438029239616e-14 -3.236396774016e-14 ] [ 3.012092047104e-14 2.146916671872e-14 -9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.373205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.943711950016567e-18 } }