{ "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" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9716706 -8.2007983 2.0409108 ] [ -4.0488047 2.7874978 -8.2655845 ] [ 3.8726085 6.0630678 7.5722929 ] [ 1.7459277 -0.681863 -1.0334178 ] [ 1.4019391 0.0320957 -0.3142014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.761141160038708e-09 -1.313912730815638e-08 3.269899568898224e-09 ] [ -6.486900232525158e-09 4.466063805691435e-09 -1.324292624314686e-08 ] [ 6.204602800211357e-09 9.71410547948529e-09 1.213215065022983e-08 ] [ 2.797284542547116e-09 -1.09246495718855e-09 -1.655717838678571e-09 ] [ 2.246154049805393e-09 5.142298016821056e-11 -5.034061373026292e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.460226 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.99634827870843e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5091049 0.3021454 2.6486569 ] [ 0.0407792 1.8685162 0.8095082 ] [ 1.0298497 2.6128831 2.9362398 ] [ 1.8789384 0.2364504 0.6960627 ] [ 2.3996805 2.5471865 0.983645 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.091049e-11 3.021454e-11 2.6486569e-10 ] [ 4.07792e-12 1.8685162e-10 8.095082000000001e-11 ] [ 1.0298497e-10 2.6128831e-10 2.9362398e-10 ] [ 1.8789384e-10 2.364504e-11 6.960627000000001e-11 ] [ 2.3996805e-10 2.5471865e-10 9.83645e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 6.2e-06 7e-07 ] [ 1.92e-05 -7e-07 1.5e-06 ] [ -3.8e-06 -1.45e-05 -8.7e-06 ] [ -1.36e-05 1.01e-05 7.7e-06 ] [ -7.8e-06 -1.1e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 9.93349504896e-15 1.12152363456e-15 ] [ 3.076179111936e-14 -1.12152363456e-15 2.4032649312e-15 ] [ -6.08827115904e-15 -2.32315610016e-14 -1.393893660096e-14 ] [ -2.178960204288e-14 1.618198387008e-14 1.233675998016e-14 ] [ -1.249697764224e-14 -1.76239428288e-15 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }