{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7154631 -5.5798494 3.289614 ] [ -9.7878068 11.0508757 2.4883421 ] [ -8.6679921 -6.1208744 -4.6333756 ] [ 0.31275 -4.3030456 -9.2363393 ] [ 3.8476572 4.4398649 11.3461178 ] [ 3.0222909 -4.0183935 0.7612643 ] [ 10.5576377 4.5314222 -4.0156234 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.146298251865093e-09 -8.939904256264907e-09 5.270542642256371e-09 ] [ -1.568179522386726e-08 1.770545468590684e-08 3.986763537172376e-09 ] [ -1.38876542918991e-08 -9.806721862533227e-09 -7.423486061705173e-09 ] [ 5.010807381552e-10 -6.894239058556309e-09 -1.479824688823624e-08 ] [ 6.16462641069279e-09 7.11344774229053e-09 1.817848467600273e-08 ] [ 4.84224382123659e-09 -6.438176118874685e-09 1.219679863709677e-09 ] [ 1.691520029381668e-08 7.260138707814102e-09 -6.433737929417407e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5902493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.376309659530357e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6575117 2.362505 3.8656515 ] [ 1.8699497 5.393939 2.9267143 ] [ 1.0465159 3.1880611 2.1957573 ] [ 2.5578643 2.5181341 0.2809681 ] [ 2.4890001 4.4988113 5.2099631 ] [ 4.2965663 2.845771 2.0885216 ] [ 4.1972296 5.3363815 2.0343141 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6575117e-10 2.362505e-10 3.8656515e-10 ] [ 1.8699497e-10 5.393938999999999e-10 2.9267143e-10 ] [ 1.0465159e-10 3.1880611e-10 2.1957573e-10 ] [ 2.5578643e-10 2.5181341e-10 2.809681e-11 ] [ 2.4890001e-10 4.4988113e-10 5.209963100000001e-10 ] [ 4.2965663e-10 2.845771e-10 2.0885216e-10 ] [ 4.1972296e-10 5.3363815e-10 2.0343141e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.65e-05 9.2e-06 2.94e-05 ] [ 2.76e-05 -2.23e-05 -3.21e-05 ] [ 3.4e-06 -8.3e-06 -2e-07 ] [ -1.93e-05 2.16e-05 -3.93e-05 ] [ -1.1e-06 2.1e-06 -3.5e-06 ] [ -2.38e-05 5.14e-05 2.32e-05 ] [ -1.33e-05 -5.37e-05 2.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.24576804512e-14 1.474002491136e-14 4.710399265152e-14 ] [ 4.422007473408001e-14 -3.572853864384e-14 -5.142986952768e-14 ] [ 5.44740051072e-15 -1.329806595264e-14 -3.2043532416e-16 ] [ -3.092200878144e-14 3.460701500928e-14 -6.296554119743999e-14 ] [ -1.76239428288e-15 3.36457090368e-15 -5.6076181728e-15 ] [ -3.813180357504e-14 8.235187830912e-14 3.717049760256e-14 ] [ -2.130894905664e-14 -8.603688453696e-14 3.588875630592e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735010429801e-18 } }