{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7315436 0.3767612 1.166558 ] [ 0.6069044 0.5624824 2.9402 ] [ 2.192795 0.1872249 0.2922769 ] [ 2.54678 0.883358 1.224646 ] [ 2.591807 0.3326772 2.854818 ] [ 2.523994 2.504234 0.7585561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.315436e-11 3.767612e-11 1.166558e-10 ] [ 6.069044000000001e-11 5.624824e-11 2.9402e-10 ] [ 2.192795e-10 1.872249e-11 2.922769e-11 ] [ 2.54678e-10 8.83358e-11 1.224646e-10 ] [ 2.591807e-10 3.326772e-11 2.854818e-10 ] [ 2.523994e-10 2.504234e-10 7.585561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -83.1980111 -9.1223622 -50.0971103 ] [ -16.5205973 7.5074643 71.2541116 ] [ -104.3639772 -310.90571 -405.9108294 ] [ 190.4399279 271.2062953 347.7732501 ] [ 15.1565694 -26.6975447 53.8586961 ] [ -1.5139119 68.0118573 -16.8781181 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.332979093796926e-07 -1.461563556372483e-08 -8.026441955358072e-08 ] [ -2.646891497378348e-08 1.202828388204916e-08 1.141616726819483e-07 ] [ -1.672095257011487e-07 -4.9812586393918e-07 -6.503408463522402e-07 ] [ 3.051184026620246e-07 4.34520389323364e-07 5.571941752404581e-07 ] [ 2.42835013442794e-08 -4.277418230351054e-08 8.629114442912692e-08 ] [ -2.425554272114545e-09 1.089670086010023e-07 -2.704172644571247e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 208.1575 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.33505082691855e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3017442 0.9741318 0.7498088 ] [ 0.3856211 0.3459422 3.1508433 ] [ 2.0771682 -0.580036 -0.1201405 ] [ 3.5858648 0.943632 1.1938798 ] [ 2.8559127 0.3229825 3.4848598 ] [ 1.987513 2.8400852 0.7778038 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.017442e-11 9.741318e-11 7.498088000000001e-11 ] [ 3.856211e-11 3.459422e-11 3.1508433e-10 ] [ 2.0771682e-10 -5.80036e-11 -1.201405e-11 ] [ 3.5858648e-10 9.436320000000001e-11 1.1938798e-10 ] [ 2.8559127e-10 3.229825e-11 3.4848598e-10 ] [ 1.987513e-10 2.8400852e-10 7.778038e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.25e-05 3.6e-06 -9e-07 ] [ 9e-06 4.1e-06 -1.86e-05 ] [ -3.4e-06 1.1e-06 -5e-06 ] [ 1.74e-05 -2.4e-06 1.85e-05 ] [ 1.08e-05 7e-06 1.4e-06 ] [ -1.2e-06 -1.34e-05 4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.207074060499999e-14 5.767835882399999e-15 -1.4419589706e-15 ] [ 1.4419589706e-14 6.568924199399999e-15 -2.98004853924e-14 ] [ -5.4474005556e-15 1.7623942974e-15 -8.010883169999999e-15 ] [ 2.78778734316e-14 -3.845223921599999e-15 2.9640267729e-14 ] [ 1.73035076472e-14 1.1215236438e-14 2.2430472876e-15 ] [ -1.9226119608e-15 -2.14691668956e-14 7.530230179799999e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.334204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.097680988578933e-18 } }