{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4488744 4.2607926 -0.4457887 ] [ -1.1928684 1.3710869 -5.2927845 ] [ -0.8297471 1.0670076 2.7171935 ] [ -0.6155153 0.9131208 -3.8576447 ] [ 4.3089541 -5.1505121 3.5305227 ] [ 1.5262626 -1.5261803 -1.8414571 ] [ -0.6644805 -1.8286209 3.0539442 ] [ -2.9814797 0.8933052 2.1360146 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.191760752807695e-10 6.826542346040108e-09 -7.142322388412357e-10 ] [ -1.911185877916965e-09 2.196723394363495e-09 -8.479975654697372e-09 ] [ -1.329401415749261e-09 1.709534645020418e-09 4.353423935756679e-09 ] [ -9.861642315295e-10 1.462980809779387e-09 -6.180628200613939e-09 ] [ 6.903705575998499e-09 -8.25203013975427e-09 5.656520975746591e-09 ] [ 2.445342275068088e-09 -2.44521041593111e-09 -2.950339538133401e-09 ] [ -1.064615130848637e-09 -2.92977367842405e-09 4.892958038779823e-09 ] [ -4.776857110085329e-09 1.431232718470697e-09 3.422272682002856e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.161789292303478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.992669067776002e-18 } }