{ "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" [ [ -16.5082502 83.3018895 -17.0439255 ] [ 41.4692134 -91.2440052 31.0494233 ] [ 76.1772873 37.0393994 -10.6569668 ] [ -12.5185519 11.5430824 50.0700172 ] [ -7.1580423 -28.4558956 -71.2105013 ] [ -18.3150151 17.5014605 -0.4983922 ] [ -63.1466413 -29.685931 18.2903452 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.644913273866582e-08 1.334643409249499e-07 -2.730737918773677e-08 ] [ 6.644100473983969e-08 -1.461890131240145e-07 4.974666051043516e-08 ] [ 1.220494697535649e-07 5.934366025607362e-08 -1.707434319627375e-08 ] [ -2.00569313456963e-08 1.849405690561664e-08 8.02210116218181e-08 ] [ -1.146844811824362e-08 -4.559137102986341e-08 -1.140918012782866e-07 ] [ -2.934388924457717e-08 2.804043107397395e-08 -7.985123374078548e-10 ] [ -1.011720732064394e-07 -4.756210500673625e-08 2.930436370723405e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.258951723632833 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.002794620493855e-18 } "relaxed-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 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -16.5082502 83.3018895 -17.0439255 ] [ 41.4692134 -91.2440052 31.0494233 ] [ 76.1772873 37.0393994 -10.6569668 ] [ -12.5185519 11.5430824 50.0700172 ] [ -7.1580423 -28.4558956 -71.2105013 ] [ -18.3150151 17.5014605 -0.4983922 ] [ -63.1466413 -29.685931 18.2903452 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.644913273866582e-08 1.334643409249499e-07 -2.730737918773677e-08 ] [ 6.644100473983969e-08 -1.461890131240145e-07 4.974666051043516e-08 ] [ 1.220494697535649e-07 5.934366025607362e-08 -1.707434319627375e-08 ] [ -2.00569313456963e-08 1.849405690561664e-08 8.02210116218181e-08 ] [ -1.146844811824362e-08 -4.559137102986341e-08 -1.140918012782866e-07 ] [ -2.934388924457717e-08 2.804043107397395e-08 -7.985123374078548e-10 ] [ -1.011720732064394e-07 -4.756210500673625e-08 2.930436370723405e-08 ] ] } "relaxed-potential-energy" { "source-value" 6.258951723632833 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.002794620493855e-18 } }