{ "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" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1196778 -1.362976 -10.4224535 ] [ -1.6102133 1.6848701 11.2875264 ] [ 2.2570748 -1.0074592 1.3623675 ] [ 6.5230959 -17.5797838 -21.2376402 ] [ -6.0502796 18.2653489 19.0101998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.793921593988778e-09 -2.183728281911501e-09 -1.669861132907513e-08 ] [ -2.579846103761217e-09 2.699459483304958e-09 1.808461090474279e-08 ] [ 3.616232475956836e-09 -1.614127576649871e-09 2.182753357437744e-09 ] [ 1.045115174621634e-08 -2.816591860307858e-08 -3.402645060940224e-08 ] [ -9.693616524423175e-09 2.9264314978335e-08 3.045769767629683e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5034515 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.215324706206691e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7737043 0.5120004 0.4866547 ] [ 0.5939928 0.7205528 2.9657952 ] [ 2.8762384 0.3853604 2.016605 ] [ 2.9095139 1.6376396 -0.1403965 ] [ 1.6053497 2.6398925 1.7348565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.737043e-11 5.120004000000001e-11 4.866547e-11 ] [ 5.939928e-11 7.205528e-11 2.9657952e-10 ] [ 2.8762384e-10 3.853604e-11 2.016605e-10 ] [ 2.9095139e-10 1.6376396e-10 -1.403965e-11 ] [ 1.6053497e-10 2.6398925e-10 1.7348565e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.8e-06 6.79e-05 8.5e-06 ] [ 3.34e-05 -1.04e-05 -1.82e-05 ] [ 9.7e-06 6.1e-06 -1.2e-06 ] [ -2.84e-05 -3.07e-05 5.76e-05 ] [ -2.45e-05 -3.29e-05 -4.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.570133088384e-14 1.0878779255232e-13 1.36185012768e-14 ] [ 5.351269913472e-14 -1.666263685632e-14 -2.915961449856e-14 ] [ 1.554111322176e-14 9.77327738688e-15 -1.92261194496e-15 ] [ -4.550181603071999e-14 -4.918682225856e-14 9.228537335808e-14 ] [ -3.92533272096e-14 -5.271161082432e-14 -7.482164819136e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }