{ "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" [ [ 0.291373 0.2175772 2.382477 ] [ 0.160359 2.066003 1.905678 ] [ 1.191739 1.933254 2.911087 ] [ 2.962853 1.944071 0.1667647 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91373e-11 2.175772e-11 2.382477e-10 ] [ 1.60359e-11 2.066003e-10 1.905678e-10 ] [ 1.191739e-10 1.933254e-10 2.911087e-10 ] [ 2.962853e-10 1.944071e-10 1.667647e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1839942 -14.7227544 0.7791905 ] [ -33.5307132 13.6555805 -36.0990719 ] [ 37.4982651 1.0080067 33.4956537 ] [ -1.7835578 0.0591672 1.8242277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.499144476031523e-09 -2.358845308780069e-08 1.248400812534777e-09 ] [ -5.372212521039536e-08 2.187865200080604e-08 -5.783708950726598e-08 ] [ 6.007884415875766e-08 1.615004781655447e-09 5.366595369869563e-08 ] [ -2.857574632548445e-09 9.47963053392048e-11 2.922734996035561e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.7667817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.40459327951188e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1138962 0.6179309 2.6964566 ] [ 0.0132814 1.7578129 0.6946378 ] [ 2.2898766 1.3226494 2.9883714 ] [ 2.1892698 2.462512 0.986541 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.138962e-11 6.179309e-11 2.6964566e-10 ] [ 1.32814e-12 1.7578129e-10 6.946378e-11 ] [ 2.2898766e-10 1.3226494e-10 2.9883714e-10 ] [ 2.1892698e-10 2.462512e-10 9.86541e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 6.4e-06 -1.5e-06 ] [ 6.9e-06 -3e-06 3e-06 ] [ -4e-06 -1.3e-06 -7.4e-06 ] [ -6.4e-06 -2.1e-06 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.767835882399999e-15 1.02539304576e-14 -2.403264951e-15 ] [ 1.10550187746e-14 -4.806529901999999e-15 4.806529901999999e-15 ] [ -6.408706535999999e-15 -2.0828296242e-15 -1.18561070916e-14 ] [ -1.02539304576e-14 -3.364570931399999e-15 9.452842140600001e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.6673908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.548886765150656e-18 } }