{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.1771734e-10 -1.1445876e-10 -1.6792279e-10 ] [ -5.592214e-11 -1.4455748e-10 5.641946400000001e-10 ] [ 5.020773e-11 6.1022476e-10 -1.7632728e-10 ] [ -2.5054461e-10 5.6056955e-10 4.9248257e-10 ] [ 5.8415887e-10 1.0945512e-10 -2.4228233e-10 ] [ 6.6987025e-10 -1.0102976e-10 4.5669849e-10 ] ] "source-value" [ [ -1.1771734 -1.1445876 -1.6792279 ] [ -0.5592214 -1.4455748 5.6419464 ] [ 0.5020773 6.1022476 -1.7632728 ] [ -2.5054461 5.6056955 4.9248257 ] [ 5.8415887 1.0945512 -2.4228233 ] [ 6.6987025 -1.0102976 4.5669849 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ -1.6021766208e-16 -3.2043532416e-16 0.0 ] [ -3.2043532416e-16 6.408706483200001e-16 -6.408706483200001e-16 ] [ -3.2043532416e-16 3.2043532416e-16 6.408706483200001e-16 ] [ 4.8065298624e-16 -4.8065298624e-16 -4.8065298624e-16 ] [ 3.2043532416e-16 -1.6021766208e-16 3.2043532416e-16 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ -1e-07 -2e-07 0.0 ] [ -2e-07 4e-07 -4e-07 ] [ -2e-07 2e-07 4e-07 ] [ 3e-07 -3e-07 -3e-07 ] [ 2e-07 -1e-07 2e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.754687572441405e-31 "source-value" 3.5917935e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -7.789129042268313e-09 -7.268677508114655e-09 -9.855438606171246e-09 ] [ 1.173758597839632e-09 -8.675249672464033e-09 9.944501201256585e-09 ] [ -3.852276030534113e-09 1.272751547707756e-08 -8.297368145347586e-09 ] [ -1.308363271654174e-08 1.222803851771978e-08 9.735731018642201e-09 ] [ 1.316552236689576e-08 -1.727204235798411e-09 -1.09028562848364e-08 ] [ 1.038575698482644e-08 -7.284422418202581e-09 9.375430656238779e-09 ] ] "source-value" [ [ -4.861592 -4.5367517 -6.151281 ] [ 0.7326025 -5.414665 6.2068695 ] [ -2.4044016 7.9438904 -5.1788099 ] [ -8.1661613 7.6321414 6.0765654 ] [ 8.2172728 -1.0780361 -6.8050277 ] [ 6.4822797 -4.5465789 5.8516836 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 8.314904929768214e-18 "source-value" 51.897555 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.127389e-10 1.171603e-10 6.946463000000001e-11 ] [ 1.009133e-10 1.283908e-10 2.574652e-10 ] [ 7.652821e-11 2.93985e-10 2.651139e-11 ] [ 2.12665e-12 2.421916e-10 2.924129e-10 ] [ 2.909562e-10 9.55426e-11 4.927479e-11 ] [ 2.967895e-10 4.293313e-11 2.317144e-10 ] ] "source-value" [ [ 1.127389 1.171603 0.6946463 ] [ 1.009133 1.283908 2.574652 ] [ 0.7652821 2.93985 0.2651139 ] [ 0.0212665 2.421916 2.924129 ] [ 2.909562 0.955426 0.4927479 ] [ 2.967895 0.4293313 2.317144 ] ] } "instance-id" 1 }