{ "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" [ [ -20.0306177 -25.7548866 -37.3417547 ] [ -22.2948171 -36.7904462 10.58072 ] [ -23.4113301 35.6051621 21.1899812 ] [ 24.9212951 11.6869419 -56.4846584 ] [ 28.7326174 -44.6579057 41.9734565 ] [ 12.0828526 59.9111344 20.0822553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.209258764352682e-08 -4.12638775218397e-08 -5.982808685289968e-08 ] [ -3.572023501692364e-08 -5.894479325607408e-08 1.695218235489648e-08 ] [ -3.750908605708088e-08 5.704575876640237e-08 3.395009275353928e-08 ] [ 3.992831669823869e-08 1.872454523509556e-08 -9.049839986795181e-08 ] [ 4.603472823194182e-08 -7.15498530359154e-08 6.724889125251541e-08 ] [ 1.935886410778614e-08 9.59882196521136e-08 3.217532019968266e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 35.620634 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.707054748306596e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7822881 -0.3249486 0.2268297 ] [ -0.8493143 0.2646347 1.7589336 ] [ 0.0501232 1.8765336 3.1553112 ] [ 2.7378686 0.8768673 0.5985641 ] [ 4.1890242 0.7798873 2.6312711 ] [ 2.2472542 2.3520666 2.5609139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.822881000000001e-11 -3.249486e-11 2.268297e-11 ] [ -8.493143e-11 2.646347e-11 1.7589336e-10 ] [ 5.01232e-12 1.8765336e-10 3.1553112e-10 ] [ 2.7378686e-10 8.768673000000001e-11 5.985641000000001e-11 ] [ 4.1890242e-10 7.798873e-11 2.631271100000001e-10 ] [ 2.2472542e-10 2.3520666e-10 2.5609139e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.72e-05 -3.2e-06 6e-06 ] [ -2.5e-05 -1.01e-05 1.4e-06 ] [ -6.99e-05 -4.9e-06 2.18e-05 ] [ 3.73e-05 -3.5e-06 -5.08e-05 ] [ 2.36e-05 -3e-06 1.69e-05 ] [ 5.12e-05 2.47e-05 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.75574381048e-14 -5.1269652288e-15 9.613059803999999e-15 ] [ -4.005441585e-14 -1.61819840034e-14 2.2430472876e-15 ] [ -1.119921467166e-13 -7.850665506599998e-15 3.492745062119999e-14 ] [ 5.97611884482e-14 -5.607618218999999e-15 -8.13905730072e-14 ] [ 3.78113685624e-14 -4.806529901999999e-15 2.70767851146e-14 ] [ 8.20314436608e-14 3.95737628598e-14 7.690447843199998e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.737143 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.361150616651666e-18 } }