{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8605536 -3.0485858 -3.3664807 ] [ -11.5093953 -32.4149135 6.4464085 ] [ 7.0634796 4.0338809 -4.7708284 ] [ 5.3064693 31.4296185 1.6909006 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.378758858865275e-09 -4.884372895262865e-09 -5.393696671914418e-09 ] [ -1.84400840692054e-08 -5.19344165749543e-08 1.03282849868264e-08 ] [ 1.131694187661774e-08 6.462989669071663e-09 -7.643709724328671e-09 ] [ 8.50190105145294e-09 5.035579996136316e-08 2.709121409416693e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.8061076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.495879992169198e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1376933 -1.0789855 0.2843065 ] [ 0.8689666 0.7132085 1.3266576 ] [ 3.4395218 4.1397464 1.0715375 ] [ 2.0168548 2.5630052 1.6412027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.376933e-11 -1.0789855e-10 2.843065e-11 ] [ 8.689666e-11 7.132085e-11 1.3266576e-10 ] [ 3.4395218e-10 4.1397464e-10 1.0715375e-10 ] [ 2.0168548e-10 2.5630052e-10 1.6412027e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0497495 -0.086736 -0.0226394 ] [ -0.0628491 -0.0827614 0.0071012 ] [ 0.0569661 0.0908678 0.0143608 ] [ 0.0556325 0.0786296 0.0011774 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.970748579648962e-11 -1.389663913817088e-10 -3.627231738893952e-11 ] [ -1.006953586583213e-10 -1.325983801846771e-10 1.137737661962496e-11 ] [ 9.126975359815487e-11 1.455862647435302e-10 2.300853801598464e-11 ] [ 8.913309085665601e-11 1.259785068228557e-10 1.88640275332992e-12 ] ] } "relaxed-potential-energy" { "source-value" -8.3996512 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.345772477551466e-18 } }