{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.61188 5.080623 2.93239 ] [ 4.855786 1.762639 3.084137 ] [ 3.780411 3.32193 1.747479 ] [ 4.346291 4.090656 3.759617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61188e-10 5.080623e-10 2.93239e-10 ] [ 4.855786000000001e-10 1.762639e-10 3.084137e-10 ] [ 3.780411e-10 3.32193e-10 1.747479e-10 ] [ 4.346291e-10 4.090656e-10 3.759617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.316585 0.973966 -1.3222301 ] [ -0.0751839 0.3487029 0.478963 ] [ -1.0858534 -0.4029217 -2.8534214 ] [ 3.4776222 -0.9197472 3.6966885 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.711578357674889e-09 1.560465567510444e-09 -2.118446170991483e-09 ] [ -1.204578878329926e-10 5.586836385880385e-10 7.67383327150542e-10 ] [ -1.739728945429455e-09 -6.455517330715577e-10 -4.571685094035567e-09 ] [ 5.571765030719674e-09 -1.473597473026925e-09 5.922747937876509e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8658317 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.58068050247165e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5777769 5.0032561 2.879453 ] [ 4.7873884 1.8406332 3.118188 ] [ 3.7318289 3.3535798 1.6373516 ] [ 4.4973738 4.058379 3.8886304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5777769e-10 5.0032561e-10 2.879453e-10 ] [ 4.7873884e-10 1.8406332e-10 3.118188e-10 ] [ 3.7318289e-10 3.3535798e-10 1.6373516e-10 ] [ 4.4973738e-10 4.058379000000001e-10 3.8886304e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.07e-05 1.57e-05 1.6e-06 ] [ 1.7e-06 -1.22e-05 -6e-07 ] [ 1.44e-05 -1e-07 1.26e-05 ] [ 4.5e-06 -3.3e-06 -1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.316505632379999e-14 2.515417315379999e-14 2.5634826144e-15 ] [ 2.7237002778e-15 -1.95465549348e-14 -9.613059803999998e-16 ] [ 2.30713435296e-14 -1.602176634e-16 2.01874255884e-14 ] [ 7.209794853e-15 -5.2871828922e-15 -2.19498198858e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689827071333901e-18 } }