{ "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" [ [ 0.468554 0.0062453 1.779472 ] [ 0.0137549 1.819656 0.3703857 ] [ 0.6368997 2.724291 2.946976 ] [ 2.361208 0.5254432 0.0878272 ] [ 1.952332 1.317185 1.267695 ] [ 2.764287 2.133831 2.76552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.685540000000001e-11 6.2453e-13 1.779472e-10 ] [ 1.37549e-12 1.819656e-10 3.703857e-11 ] [ 6.368997e-11 2.724291e-10 2.946976e-10 ] [ 2.361208e-10 5.254432e-11 8.782719999999999e-12 ] [ 1.952332e-10 1.317185e-10 1.267695e-10 ] [ 2.764287e-10 2.133831e-10 2.76552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5539516 -12.2191736 9.6365126 ] [ -4.4676734 9.7374611 -6.3452473 ] [ -5.0005506 9.2612246 10.836867 ] [ 59.1220164 -79.8028702 -117.6899118 ] [ -66.63884 62.2195077 81.1617977 ] [ 19.5389992 10.8038504 22.3999818 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.091881577886914e-09 -1.957727442870966e-08 1.543939532096659e-08 ] [ -7.158001929823334e-09 1.560113264890394e-08 -1.016620696101159e-08 ] [ -8.011765328454681e-09 1.483811765634599e-08 1.736257509316567e-08 ] [ 9.472391323104478e-08 -1.278582939605749e-07 -1.885600267434809e-07 ] [ -1.067671923648646e-07 9.968664141592307e-08 1.300355358483749e-07 ] [ 3.130492796998469e-08 1.730967666811155e-08 3.588872744198526e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 35.824558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.739726975097778e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5153739 -1.2187723 1.8280645 ] [ -0.2984427 2.2205387 0.2474748 ] [ 1.0887328 4.1149772 3.2714774 ] [ 3.1069655 0.5133919 -0.4440028 ] [ 1.4263673 0.8722823 1.1869975 ] [ 2.3580388 2.0242336 3.1278644 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.153739000000001e-11 -1.2187723e-10 1.8280645e-10 ] [ -2.984427e-11 2.2205387e-10 2.474748e-11 ] [ 1.0887328e-10 4.114977200000001e-10 3.2714774e-10 ] [ 3.1069655e-10 5.133919e-11 -4.440028e-11 ] [ 1.4263673e-10 8.722823e-11 1.1869975e-10 ] [ 2.3580388e-10 2.0242336e-10 3.1278644e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-07 3.1e-06 9.3e-06 ] [ 1e-07 1.08e-05 -1.5e-06 ] [ -1.1e-05 -1.04e-05 3.5e-06 ] [ 8.1e-06 -9e-06 -7.8e-06 ] [ -1.27e-05 -7.4e-06 -1.84e-05 ] [ 1.52e-05 1.28e-05 1.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.204353268e-16 4.9667475654e-15 1.49002426962e-14 ] [ 1.602176634e-16 1.73035076472e-14 -2.403264951e-15 ] [ -1.7623942974e-14 -1.66626369936e-14 5.607618218999999e-15 ] [ 1.29776307354e-14 -1.4419589706e-14 -1.24969777452e-14 ] [ -2.03476432518e-14 -1.18561070916e-14 -2.94800500656e-14 ] [ 2.43530848368e-14 2.05078609152e-14 2.38724318466e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.272509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.76736103303547e-18 } }