{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.8770544e-10 1.9098521e-10 3.8534855e-10 ] [ 1.9737509e-10 3.072687e-10 1.5756522e-10 ] [ 2.6438714e-10 5.193447800000001e-10 3.0122105e-10 ] [ 8.890421e-11 3.5251737e-10 3.8596359e-10 ] [ 4.617824200000001e-10 1.2820342e-10 2.2789049e-10 ] [ 4.4793628e-10 3.6493648e-10 1.7356255e-10 ] [ 4.359187300000001e-10 3.8812304e-10 4.294725500000001e-10 ] ] "source-value" [ [ 2.8770544 1.9098521 3.8534855 ] [ 1.9737509 3.072687 1.5756522 ] [ 2.6438714 5.1934478 3.0122105 ] [ 0.8890421 3.5251737 3.8596359 ] [ 4.6178242 1.2820342 2.2789049 ] [ 4.4793628 3.6493648 1.7356255 ] [ 4.3591873 3.8812304 4.2947255 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.933246011339072e-11 5.078082777859392e-11 -1.088486752639104e-10 ] [ 9.12103128455232e-11 -5.210374501438847e-11 1.317663698654957e-10 ] [ 2.28131846206105e-10 -2.048305905215001e-10 -1.703277169925721e-10 ] [ 2.086001916749184e-11 -1.65120322539648e-12 1.07850519229152e-11 ] [ -2.328571457138304e-11 2.9816506913088e-12 -1.430679635309568e-11 ] [ -2.335638658212653e-10 1.933819170422496e-10 1.556618728587552e-10 ] [ -3.402013771308096e-11 1.14411432491328e-11 -4.73010603758784e-12 ] ] "source-value" [ [ -0.0307909 0.0316949 -0.067938 ] [ 0.056929 -0.0325206 0.0822421 ] [ 0.1423887 -0.1278452 -0.1063102 ] [ 0.0130198 -0.0010306 0.0067315 ] [ -0.0145338 0.001861 -0.0089296 ] [ -0.1457791 0.1206995 0.0971565 ] [ -0.0212337 0.007141 -0.0029523 ] ] } "species" { "source-value" [ "Si" "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" -2.653346436893403e-18 "source-value" -16.560886 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.47834759413161e-09 -8.250469231303529e-09 3.794731133497826e-09 ] [ -2.318566825447381e-09 -9.380804997495592e-10 -4.176796584641829e-09 ] [ -4.560812205168669e-09 9.591644871868727e-09 2.57609893308049e-09 ] [ -3.425493990121244e-09 1.401682481520357e-09 1.205139950658255e-09 ] [ 1.642441882763297e-09 -2.556788378922973e-09 -1.434407579870845e-09 ] [ 5.242393039899563e-09 -1.739446787793268e-09 -9.529264445573202e-09 ] [ 4.898385852423706e-09 2.491457544380247e-09 7.564498592849306e-09 ] ] "source-value" [ [ -0.922712 -5.1495379 2.3684849 ] [ -1.4471356 -0.5855038 -2.6069514 ] [ -2.8466351 5.9866339 1.6078745 ] [ -2.1380252 0.8748614 0.7521892 ] [ 1.0251316 -1.5958218 -0.8952868 ] [ 3.2720444 -1.0856773 -5.9476991 ] [ 3.057332 1.5550455 4.7213887 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.040333794785225e-18 "source-value" -12.734762 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "instance-id" 1 }