{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7481215 0.3697243 2.264709 ] [ 0.2413431 2.204484 1.035234 ] [ 2.632044 0.6504598 2.339521 ] [ 2.588426 1.874203 0.0457334 ] [ 2.842468 2.848588 2.160611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481215e-11 3.697243e-11 2.264709e-10 ] [ 2.413431e-11 2.204484e-10 1.035234e-10 ] [ 2.632044e-10 6.504598e-11 2.339521e-10 ] [ 2.588426e-10 1.874203e-10 4.57334e-12 ] [ 2.842468e-10 2.848588e-10 2.160611e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.427549 -2.6934757 -0.0096071 ] [ 0.7330454 0.6259423 -0.5508529 ] [ 12.2825207 0.5404116 0.4953932 ] [ -0.5435373 0.1342285 0.4738186 ] [ -0.0444798 1.3928933 -0.4087518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.991112846164642e-08 -4.315423795232915e-09 -1.539227101368768e-11 ] [ 1.174468201864984e-09 1.00287011902978e-09 -8.825636378798803e-10 ] [ 1.967876751003205e-08 8.658348311291213e-10 7.937074031432985e-10 ] [ -8.708427545927559e-10 2.150577645450528e-10 7.591410834201869e-10 ] [ -7.126449565785984e-11 2.23166108052896e-09 -6.548925776699174e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.048193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.609897990588622e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5289103 0.3201376 2.3060047 ] [ 0.3909104 2.2564466 1.0009227 ] [ 2.8568992 0.5917397 2.2112736 ] [ 2.5311058 1.7886627 0.1472376 ] [ 2.7445769 2.9904725 2.1803698 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.289103e-11 3.201376e-11 2.3060047e-10 ] [ 3.909104e-11 2.2564466e-10 1.0009227e-10 ] [ 2.8568992e-10 5.917397e-11 2.2112736e-10 ] [ 2.5311058e-10 1.7886627e-10 1.472376e-11 ] [ 2.744576900000001e-10 2.9904725e-10 2.1803698e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0397026 0.0584362 0.034654 ] [ 0.1916975 -0.0220212 0.0736348 ] [ -0.0802865 0.0619622 -0.062731 ] [ 0.0028366 -0.0615141 -0.1301439 ] [ -0.1539502 -0.0368631 0.0845862 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.361057750497407e-11 9.362511344839297e-11 5.55218286172032e-11 ] [ 3.07133252765808e-10 -3.528185180196096e-11 1.179759550372838e-10 ] [ -1.286331532658592e-10 9.927438821333377e-11 -1.005061415994048e-10 ] [ 4.544734202561281e-12 -9.855645286955329e-11 -2.085135139197331e-10 ] [ -2.466554112074842e-10 -5.906119699021249e-11 1.35522032082313e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.694347 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.194076260052262e-18 } }