{ "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" [ [ 0.0964554 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.0320969 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.64554e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.20969e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -338.0579647 -549.538761 -209.678389 ] [ 13.0826954 -51.1705003 157.5254368 ] [ 400.7088437 554.8963818 -73.0845925 ] [ -79.3918514 65.0724052 142.5811315 ] [ 8.1249785 -49.4637675 -39.5795837 ] [ -4.4667016 30.2042419 22.2359968 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.416285675175717e-07 -8.804581550975989e-07 -3.359418127428079e-07 ] [ 2.096078870692771e-08 -8.198417925529939e-08 2.523835720222679e-07 ] [ 6.420063411239414e-07 8.890420098864706e-07 -1.17094425444195e-07 ] [ -1.271997681951077e-07 1.042574862706644e-07 2.284401554565105e-07 ] [ 1.301765059720265e-08 -7.924969186518686e-08 -6.341348366513677e-08 ] [ -7.156444875609954e-09 4.839253022116777e-08 3.562599421314361e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 179.00074 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.867908007338994e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.3249565 0.5483427 0.5546143 ] [ 0.441805 0.6905544 3.1161727 ] [ 1.2137977 2.6600308 1.1400201 ] [ -0.4408475 3.1292547 3.0815424 ] [ 2.2518811 0.0432071 1.0578581 ] [ 2.8987032 1.7500105 3.0115604 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.249565e-11 5.483427e-11 5.546143e-11 ] [ 4.41805e-11 6.905544000000001e-11 3.1161727e-10 ] [ 1.2137977e-10 2.6600308e-10 1.1400201e-10 ] [ -4.408475e-11 3.1292547e-10 3.0815424e-10 ] [ 2.2518811e-10 4.32071e-12 1.0578581e-10 ] [ 2.8987032e-10 1.7500105e-10 3.0115604e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.24e-05 -1.95e-05 -2.2e-06 ] [ 1.33e-05 1.72e-05 -5.6e-06 ] [ 2.07e-05 -1.61e-05 8.2e-06 ] [ -2.3e-05 2.57e-05 1.54e-05 ] [ 2.45e-05 5.5e-06 -1.97e-05 ] [ -1.31e-05 -1.29e-05 3.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.588875630592e-14 -3.12424441056e-14 -3.52478856576e-15 ] [ 2.130894905664e-14 2.755743787776e-14 -8.972189076479999e-15 ] [ 3.316505605055999e-14 -2.579504359488e-14 1.313784829056e-14 ] [ -3.68500622784e-14 4.117593915456e-14 2.467351996032e-14 ] [ 3.92533272096e-14 8.8119714144e-15 -3.156287942976e-14 ] [ -2.098851373248e-14 -2.066807840832e-14 6.24848882112e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.469338 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279549478685303e-18 } }