{ "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" [ [ 1.945352 2.412058 0.9382196 ] [ 2.796213 2.491472 3.200201 ] [ 0.8595983 4.85908 2.462047 ] [ 3.121335 4.067774 1.150086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.945352e-10 2.412058e-10 9.382196000000001e-11 ] [ 2.796213e-10 2.491472e-10 3.200201e-10 ] [ 8.595983000000001e-11 4.85908e-10 2.462047e-10 ] [ 3.121335e-10 4.067774e-10 1.150086e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -201.3169029 -232.2603569 -196.3124745 ] [ 72.6142378 67.682967 78.1741168 ] [ 8.4323767 11.3164236 1.26506 ] [ 120.2702884 153.2609664 116.8732978 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.225452351982437e-07 -3.72122113763844e-07 -3.145272570152962e-07 ] [ 1.163408341403716e-07 1.084400673537779e-07 1.252487422886485e-07 ] [ 1.351015680651866e-08 1.813090932298937e-08 2.026849555909248e-09 ] [ 1.926942442513534e-07 2.455511372472944e-07 1.872516653309561e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 86.852631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.391532548431693e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.4487175 2.0904842 0.647072 ] [ 2.9033456 2.5205874 3.5716327 ] [ 0.7072241 4.722644 2.4844403 ] [ 3.6632111 4.4966684 1.0474086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4487175e-10 2.0904842e-10 6.47072e-11 ] [ 2.9033456e-10 2.5205874e-10 3.5716327e-10 ] [ 7.072241000000001e-11 4.722644e-10 2.4844403e-10 ] [ 3.6632111e-10 4.4966684e-10 1.0474086e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3e-06 7e-06 7.8e-06 ] [ -4.8e-06 6.8e-06 -1.06e-05 ] [ 9.1e-06 -9e-06 -3.1e-06 ] [ -6.6e-06 -4.8e-06 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.68500622784e-15 1.12152363456e-14 1.249697764224e-14 ] [ -7.69044777984e-15 1.089480102144e-14 -1.698307218048e-14 ] [ 1.457980724928e-14 -1.44195895872e-14 -4.96674752448e-15 ] [ -1.057436569728e-14 -7.69044777984e-15 9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.5103029 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.363500834230644e-18 } }