{ "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" [ [ 0.0409962 0.6822116 1.595736 ] [ 0.3790876 1.575629 0.6188876 ] [ 0.3154214 2.976467 2.437822 ] [ 1.63698 0.1180447 0.631717 ] [ 1.584423 0.2949968 2.813326 ] [ 2.305753 1.803926 1.00695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.099619999999999e-12 6.822116000000001e-11 1.595736e-10 ] [ 3.790876e-11 1.575629e-10 6.188876e-11 ] [ 3.154214e-11 2.976467e-10 2.437822e-10 ] [ 1.63698e-10 1.180447e-11 6.31717e-11 ] [ 1.584423e-10 2.949968e-11 2.813326e-10 ] [ 2.305753e-10 1.803926e-10 1.00695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -37.72573 -51.9913346 53.6980434 ] [ -1.4107546 59.0254853 -58.781116 ] [ 0.2853769 9.8660783 5.3580701 ] [ 16.0976829 -31.4317754 -14.3560297 ] [ 3.8832978 -6.3306035 15.0519056 ] [ 18.8701271 20.8621498 -0.9708734 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.044328260861318e-08 -8.329930078031012e-08 8.603374971818376e-08 ] [ -2.260278037806056e-09 9.456925257903407e-08 -9.417772979973281e-08 ] [ 4.572241972963795e-10 1.580719999124221e-08 8.584574646827517e-09 ] [ 2.579133119143194e-08 -5.035925569611657e-08 -2.300089515285044e-08 ] [ 6.221728946764074e-09 -1.014274492325465e-08 2.41158112508086e-08 ] [ 3.023327647114451e-08 3.34248486691874e-08 -1.555510663236607e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 30.778826 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.931311543287118e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.444186 0.3254254 2.0840798 ] [ -0.0534049 2.3632394 1.4190144 ] [ -0.1972854 4.5491509 1.2101867 ] [ 2.2377828 -0.2105183 0.2586442 ] [ 1.2590581 -1.4150454 3.1567891 ] [ 2.5723247 1.839023 0.9757245 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.441860000000001e-11 3.254254e-11 2.0840798e-10 ] [ -5.34049e-12 2.3632394e-10 1.4190144e-10 ] [ -1.972854e-11 4.5491509e-10 1.2101867e-10 ] [ 2.2377828e-10 -2.105183e-11 2.586442e-11 ] [ 1.2590581e-10 -1.4150454e-10 3.1567891e-10 ] [ 2.5723247e-10 1.839023e-10 9.757245e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0533953 -0.1373119 0.0705315 ] [ -0.0156878 0.1067003 -0.0214088 ] [ -0.0052856 -0.0207947 -0.0066255 ] [ -2.9e-05 -0.0001778 -6.22e-05 ] [ -0.0324219 0.0514063 -0.0424972 ] [ 2.9e-05 0.0001778 6.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.554870132060224e-11 -2.199979159376275e-10 1.130039203299552e-10 ] [ -2.513462639178624e-11 1.709527260923462e-10 -3.430067883938304e-11 ] [ -8.46846474690048e-12 -3.331678217654976e-11 -1.06152212011104e-11 ] [ -4.64631220032e-14 -2.8486700317824e-13 -9.965538581376e-14 ] [ -5.194561018191552e-11 8.236197202183104e-11 -6.808802028946175e-11 ] [ 4.64631220032e-14 2.8486700317824e-13 9.965538581376e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.301474 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.810695742337906e-18 } }