{ "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" [ [ 3.051773 2.11113 1.612774 ] [ 4.096623 0.6333142 0.1280934 ] [ 4.940584 2.852779 0.2569481 ] [ 3.858102 4.269978 1.799879 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.051773e-10 2.11113e-10 1.612774e-10 ] [ 4.096623e-10 6.333142000000001e-11 1.280934e-11 ] [ 4.940584000000001e-10 2.852779e-10 2.569481e-11 ] [ 3.858102e-10 4.269978e-10 1.799879e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8532505 -1.3420808 1.9461295 ] [ 0.1803881 0.6331197 0.1006102 ] [ 2.3942418 0.8105771 -1.7705971 ] [ 0.2786206 -0.1016159 -0.2761426 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.57141124438591e-09 -2.150250480984561e-09 3.118043185949194e-09 ] [ 2.890135964905325e-10 1.01436958150791e-09 1.611953102540122e-10 ] [ 3.83599823650211e-09 1.298687678975864e-09 -2.83680927847628e-09 ] [ 4.463994113932685e-10 -1.628066192815507e-10 -4.424292177269261e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6164131 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.540719224477486e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8469489 2.0173366 1.7664326 ] [ 4.0907943 0.8687097 0.2153861 ] [ 5.1265917 2.9162642 0.132414 ] [ 3.8827471 4.0648907 1.6834617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8469489e-10 2.0173366e-10 1.7664326e-10 ] [ 4.0907943e-10 8.687097000000001e-11 2.153861e-11 ] [ 5.1265917e-10 2.9162642e-10 1.32414e-11 ] [ 3.8827471e-10 4.064890700000001e-10 1.6834617e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -7e-07 4e-07 ] [ -6e-07 -1.8e-06 -1e-06 ] [ 1e-07 1.1e-06 1.1e-06 ] [ 5e-07 1.4e-06 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -1.12152363456e-15 6.408706483200001e-16 ] [ -9.6130597248e-16 -2.88391791744e-15 -1.6021766208e-15 ] [ 1.6021766208e-16 1.76239428288e-15 1.76239428288e-15 ] [ 8.010883104e-16 2.24304726912e-15 -9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.873935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.902414105389885e-18 } }