{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2350719 -13.6311947 8.5862029 ] [ -10.9774471 -1.1519004 -15.4095989 ] [ -3.6921491 19.4178022 1.8111556 ] [ -16.3128292 0.2356496 8.399388 ] [ 10.2360969 -14.3771516 -2.6471046 ] [ 11.7175917 4.0318191 -15.2177231 ] [ 13.2638087 5.4749758 14.4776801 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.785333185587037e-09 -2.183958146191287e-08 1.375661354782516e-08 ] [ -1.758780909968876e-08 -1.845547890370168e-09 -2.46888990934854e-08 ] [ -5.915474968527762e-09 3.111074871215881e-08 2.901791158950997e-09 ] [ -2.613603356334356e-08 3.775522798208717e-10 1.345730308262807e-08 ] [ 1.640003514142336e-08 -2.303473616721731e-08 -4.241129102932136e-09 ] [ 1.877365147382013e-08 6.459686301314897e-09 -2.43814801726281e-08 ] [ 2.125096420190364e-08 8.771878226205777e-09 2.319580057964141e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 144.4039 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.313605525323411e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.3526864 -2.7207691 7.1699571 ] [ -1.2793281 2.3921842 -2.5646625 ] [ 1.7416046 10.9291851 3.178464 ] [ -5.3151361 4.7074469 6.5685056 ] [ 9.0331494 -3.5277256 0.8170599 ] [ 8.1687073 5.8470681 -2.554287 ] [ 8.1384097 4.8864003 7.9952029 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3526864e-10 -2.7207691e-10 7.1699571e-10 ] [ -1.2793281e-10 2.3921842e-10 -2.5646625e-10 ] [ 1.7416046e-10 1.09291851e-09 3.178464e-10 ] [ -5.3151361e-10 4.7074469e-10 6.5685056e-10 ] [ 9.033149399999999e-10 -3.5277256e-10 8.170599e-11 ] [ 8.168707299999999e-10 5.847068100000001e-10 -2.554287e-10 ] [ 8.1384097e-10 4.8864003e-10 7.9952029e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 6.2172489e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.961130833274518e-34 } }