{ "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" [ [ 1.2976724 -1.8246288 -0.6506204 ] [ -2.5435069 4.6031348 -1.52748 ] [ -2.9861744 -2.6951703 0.4342101 ] [ 1.4015162 -0.1460467 0.1517686 ] [ 0.750133 0.743865 1.9554317 ] [ -1.3211598 -0.2040707 -0.089685 ] [ 3.4015195 -0.4770833 -0.273625 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.079100380737426e-09 -2.923377604998359e-09 -1.042408793895544e-09 ] [ -4.075147290023484e-09 7.375034958950884e-09 -2.447292744739584e-09 ] [ -4.784378809311467e-09 -4.318138843734523e-09 6.956812707352301e-10 ] [ 2.245476489312457e-09 -2.339926082849914e-10 2.431601026915469e-10 ] [ 1.201845555090566e-09 1.191803112031392e-09 3.1329469533112e-09 ] [ -2.116731343900804e-09 -3.269573045302906e-10 -1.43691210236448e-10 ] [ 5.449835018095306e-09 -7.643717094341127e-10 -4.383955778664e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.611835158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.059332771221938e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8521083 2.2071075 3.5086671 ] [ 1.7463439 5.3875759 2.1358871 ] [ 0.8024322 3.2696321 2.8525172 ] [ 2.5831063 3.2912388 1.1521453 ] [ 2.3988323 4.4478437 4.327668 ] [ 4.6839213 2.6500167 2.0241992 ] [ 4.0478932 4.8901883 2.6008061 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8521083e-10 2.2071075e-10 3.5086671e-10 ] [ 1.7463439e-10 5.3875759e-10 2.1358871e-10 ] [ 8.024322000000001e-11 3.2696321e-10 2.8525172e-10 ] [ 2.5831063e-10 3.2912388e-10 1.1521453e-10 ] [ 2.3988323e-10 4.4478437e-10 4.327668e-10 ] [ 4.683921299999999e-10 2.6500167e-10 2.0241992e-10 ] [ 4.0478932e-10 4.8901883e-10 2.6008061e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 -2.73e-05 2e-07 ] [ 1.51e-05 -1.06e-05 1.03e-05 ] [ -1.13e-05 4.3e-06 1.14e-05 ] [ -1.47e-05 1.3e-05 7.8e-06 ] [ 3.6e-06 -1.03e-05 -2.77e-05 ] [ 2e-05 2.13e-05 2.38e-05 ] [ 6.6e-06 9.7e-06 -2.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.092200878144e-14 -4.373942174784e-14 3.2043532416e-16 ] [ 2.419286697408e-14 -1.698307218048e-14 1.650241919424e-14 ] [ -1.810459581504e-14 6.889359469440001e-15 1.826481347712e-14 ] [ -2.355199632576e-14 2.08282960704e-14 1.249697764224e-14 ] [ 5.76783583488e-15 -1.650241919424e-14 -4.438029239616e-14 ] [ 3.2043532416e-14 3.412636202304e-14 3.813180357504e-14 ] [ 1.057436569728e-14 1.554111322176e-14 -4.133615681664e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }