{ "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" [ [ 0.0409962 0.6822116 1.595736 ] [ 0.3790876 1.575629 0.6188876 ] [ 0.3154214 2.976467 2.437822 ] [ 1.63698 0.1180447 0.631717 ] [ 1.584423 0.2949968 2.813326 ] [ 2.305753 1.803926 1.00695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.099619999999999e-12 6.822116000000001e-11 1.595736e-10 ] [ 3.790876e-11 1.575629e-10 6.188876e-11 ] [ 3.154214e-11 2.976467e-10 2.437822e-10 ] [ 1.63698e-10 1.180447e-11 6.31717e-11 ] [ 1.584423e-10 2.949968e-11 2.813326e-10 ] [ 2.305753e-10 1.803926e-10 1.00695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -721.0638645 -1810.6531261 1956.7717538 ] [ 627.4213172 1868.0471326 -1957.2616128 ] [ 1.0150696 -2.8246223 -9.7847449 ] [ -21.5976503 -247.6095136 -61.2949489 ] [ 21.2045139 2.2308861 27.7465322 ] [ 93.0206141 190.8092433 43.8230205 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.155271665805599e-06 -2.900986107015854e-06 3.135093956180173e-06 ] [ 1.005239765809381e-06 2.992941442404197e-06 -3.135878796817462e-06 ] [ 1.626320781604808e-09 -4.525543811650324e-09 -1.567688951927203e-08 ] [ -3.460325037487411e-08 -3.967141737775797e-07 -9.820533410071069e-08 ] [ 3.397337642600863e-08 3.574273553087691e-09 4.445484519911439e-08 ] [ 1.490354531634788e-07 3.05710108647799e-07 7.021221889793911e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 613.80037 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.834166026523898e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.3048171 0.567108 2.1652768 ] [ 0.2481664 1.9743111 -0.1665539 ] [ 0.1424302 3.1677375 2.2550028 ] [ 1.6125443 -0.2700518 0.3359905 ] [ 2.1195633 -0.0845541 2.9832376 ] [ 2.4447742 2.0967243 1.5314849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.048171e-11 5.671079999999999e-11 2.1652768e-10 ] [ 2.481664e-11 1.9743111e-10 -1.665539e-11 ] [ 1.424302e-11 3.1677375e-10 2.2550028e-10 ] [ 1.6125443e-10 -2.700518e-11 3.359905000000001e-11 ] [ 2.1195633e-10 -8.455409999999999e-12 2.9832376e-10 ] [ 2.4447742e-10 2.0967243e-10 1.5314849e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.72e-05 4.64e-05 -9.9e-06 ] [ 5.5e-06 -1.98e-05 2.69e-05 ] [ 2.6e-06 -5.05e-05 -8.2e-06 ] [ -4e-07 2.73e-05 1.52e-05 ] [ -2.13e-05 5e-06 -1.57e-05 ] [ -1.37e-05 -8.4e-06 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.357920408576e-14 7.434099520512001e-14 -1.586154854592e-14 ] [ 8.8119714144e-15 -3.172309709184e-14 4.309855109952001e-14 ] [ 4.16565921408e-15 -8.090991935040001e-14 -1.313784829056e-14 ] [ -6.408706483200001e-16 4.373942174784e-14 2.435308463616e-14 ] [ -3.412636202304e-14 8.010883104e-15 -2.515417294656e-14 ] [ -2.194981970496e-14 -1.345828361472e-14 -1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.832972 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.337810068018102e-18 } }