{ "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" [ [ 1.009597 0.3628337 1.078601 ] [ 0.0352367 0.1167127 2.680629 ] [ 0.3335965 1.756245 2.167544 ] [ 2.066416 0.0072977 2.832654 ] [ 2.311694 1.962933 1.086024 ] [ 2.552148 1.611374 2.965257 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.009597e-10 3.628337e-11 1.078601e-10 ] [ 3.52367e-12 1.167127e-11 2.680629e-10 ] [ 3.335965e-11 1.756245e-10 2.167544e-10 ] [ 2.066416e-10 7.2977e-13 2.832654e-10 ] [ 2.311694e-10 1.962933e-10 1.086024e-10 ] [ 2.552148e-10 1.611374e-10 2.965257e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.0370292 -16.4667687 -32.2500005 ] [ -22.3691285 -26.8978586 21.7637455 ] [ -7.9670044 38.5287675 3.8076611 ] [ 4.415228 -30.7499202 5.9226197 ] [ 7.1726283 9.8841058 -15.0648282 ] [ 12.7112472 25.7016743 15.8208024 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.672387123015711e-09 -2.638267204862255e-08 -5.167019724758831e-08 ] [ -3.583929500564346e-08 -4.309512055355595e-08 3.486936450842264e-08 ] [ -1.276454829265519e-08 6.172989102531858e-08 6.100545644610737e-09 ] [ 7.073975135382551e-09 -4.92668036418046e-08 9.489082895408089e-09 ] [ 1.149181746662714e-08 1.583608336074388e-08 -2.413651573726427e-08 ] [ 2.036566325283793e-08 4.11786220181383e-08 2.534771993641112e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.699636 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.675576659550523e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0304945 0.1758106 0.7538804 ] [ -0.2144461 -0.1216915 2.8860513 ] [ 0.2478262 2.1014642 2.1980021 ] [ 2.1494803 -0.3026199 2.9137835 ] [ 2.4018902 2.1122347 0.9023519 ] [ 2.6934431 1.852198 3.1566398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0304945e-10 1.758106e-11 7.538804e-11 ] [ -2.144461e-11 -1.216915e-11 2.8860513e-10 ] [ 2.478262e-11 2.1014642e-10 2.1980021e-10 ] [ 2.1494803e-10 -3.026199e-11 2.9137835e-10 ] [ 2.4018902e-10 2.1122347e-10 9.023519e-11 ] [ 2.6934431e-10 1.852198e-10 3.1566398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1786951 -0.2725527 -1.0623355 ] [ -1.4203043 -0.2990642 0.2355235 ] [ -0.3720842 0.5478044 0.1419264 ] [ 0.6518507 -2.0291584 0.6771691 ] [ -0.21041 0.4632917 -0.8965392 ] [ 1.1722526 1.5896792 0.9042557 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.863011138302933e-10 -4.366775674736117e-10 -1.702049115568707e-09 ] [ -2.275578362629726e-09 -4.791536733059028e-10 3.77350248457899e-10 ] [ -5.961446111205827e-10 8.776794096823895e-10 2.273911618277376e-10 ] [ 1.044379960396544e-09 -3.251070175164825e-09 1.084944509286809e-09 ] [ -3.3711398555994e-10 7.422751364661377e-10 -1.436414157705052e-09 ] [ 1.878155724865748e-09 2.546946869795813e-09 1.448777353701314e-09 ] ] } "relaxed-potential-energy" { "source-value" -12.185289 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.952298531433722e-18 } }