{ "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" [ [ -5.1787822 -6.2887359 -7.2940684 ] [ -6.245094 -11.5174583 1.4147688 ] [ -8.6195041 12.4550858 6.4282416 ] [ 7.6387685 1.735593 -20.3388399 ] [ 10.6307221 -16.5446632 12.1887379 ] [ 1.7738897 20.1601786 7.6011601 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.29732376505519e-09 -1.007566563336565e-08 -1.168638586099606e-08 ] [ -1.000574360149835e-08 -1.845300241929891e-08 2.266709495197271e-09 ] [ -1.380996795190974e-08 1.995524727881807e-08 1.029917840437398e-08 ] [ 1.223865630240349e-08 2.780726527824134e-09 -3.258641378197421e-08 ] [ 1.703229441084188e-08 -2.650747257805011e-08 1.952851090043889e-08 ] [ 2.842084605217926e-09 3.230016682407247e-08 1.217840100317779e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.4032896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.657024272531784e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7422801 0.0049451 0.1156542 ] [ 0.4652819 -0.154237 2.3975916 ] [ 0.0495143 2.0638237 2.863022 ] [ 2.8432095 1.0862122 0.4259093 ] [ 2.723179 0.224065 2.6834255 ] [ 2.3337792 2.6002319 2.4462209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.422801e-11 4.9451e-13 1.156542e-11 ] [ 4.652819e-11 -1.54237e-11 2.3975916e-10 ] [ 4.95143e-12 2.0638237e-10 2.863022e-10 ] [ 2.8432095e-10 1.0862122e-10 4.259093e-11 ] [ 2.723179e-10 2.24065e-11 2.6834255e-10 ] [ 2.3337792e-10 2.6002319e-10 2.4462209e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.3e-06 1e-06 1.42e-05 ] [ 7.1e-06 -2.64e-05 -2.31e-05 ] [ 1.95e-05 2.91e-05 -4.3e-06 ] [ -4.3e-06 -3e-07 2.64e-05 ] [ 7.4e-06 5e-06 -1.01e-05 ] [ -2.04e-05 -8.4e-06 -3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.490024257344e-14 1.6021766208e-15 2.275090801536e-14 ] [ 1.137545400768e-14 -4.229746278912e-14 -3.701027994048e-14 ] [ 3.12424441056e-14 4.662333966527999e-14 -6.889359469440001e-15 ] [ -6.889359469440001e-15 -4.8065298624e-16 4.229746278912e-14 ] [ 1.185610699392e-14 8.010883104e-15 -1.618198387008e-14 ] [ -3.268440306432e-14 -1.345828361472e-14 -4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.296262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290513674123145e-18 } }