{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -36.5564875 -25.8274847 16.7276214 ] [ 3.0373593 -1.5175623 -3.2768813 ] [ 43.7937918 -20.6824521 -37.3233194 ] [ 17.797178 2.3817125 36.5744429 ] [ -28.0718416 45.6457866 -12.7018636 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.856994961106744e-08 -4.13801921604097e-08 2.680060392867377e-08 ] [ 4.866386059429453e-09 -2.431402837667476e-09 -5.25014260799671e-09 ] [ 7.016538935814276e-08 -3.313694121543586e-08 -5.979854975333109e-08 ] [ 2.85142225078161e-08 3.81592408496712e-09 5.859871733316455e-08 ] [ -4.497604831432086e-08 7.313261212854592e-08 -2.035062890051052e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.061176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.573284068975406e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7102656 -0.6935563 3.0010328 ] [ -0.2468052 3.3059887 1.1942268 ] [ 3.0351176 1.1561059 0.3016152 ] [ 2.5376809 -0.3568561 1.8251045 ] [ 1.5557298 2.7712453 0.0478848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.102656e-11 -6.935563e-11 3.0010328e-10 ] [ -2.468052e-11 3.3059887e-10 1.1942268e-10 ] [ 3.0351176e-10 1.1561059e-10 3.016152e-11 ] [ 2.5376809e-10 -3.568561e-11 1.8251045e-10 ] [ 1.5557298e-10 2.7712453e-10 4.78848e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0593259 -0.2323283 0.2256283 ] [ 0.0716579 0.1586691 -0.2282985 ] [ -0.2874128 0.1024599 0.1171836 ] [ 0.1901173 0.0523242 -0.2262984 ] [ 0.0849634 -0.0811249 0.1117849 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.505056998791872e-11 -3.722309706102086e-10 3.614963872508486e-10 ] [ 1.148086120756243e-10 2.542159224633773e-10 -3.657745192637087e-10 ] [ -4.604860686786663e-10 1.641588563495059e-10 1.877488242611789e-10 ] [ 3.046014932696198e-10 8.383260994206337e-11 -3.625700058044467e-10 ] [ 1.361263731036787e-10 -1.299764181447379e-10 1.790991533384659e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.57076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.693622453608781e-18 } }