{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.1655587 -11.3170779 0.1284322 ] [ -9.2779565 12.4452404 -1.0705683 ] [ 0.7328477 1.5019607 7.6631413 ] [ 5.5707269 -2.2728751 -8.9083541 ] [ 11.1399406 -0.3572482 2.187349 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.308266735269541e-08 -1.813195777653779e-08 2.057710698932148e-10 ] [ -1.486492511556842e-08 1.993947337339281e-08 -1.715239515361102e-09 ] [ 1.174151461220641e-09 2.406406338726283e-09 1.227770593390038e-08 ] [ 8.925288473575254e-09 -3.641547377220413e-09 -1.42727567864181e-08 ] [ 1.784815253346794e-08 -5.723747185785588e-10 3.504519458203266e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.4426113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.913494750804364e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4333027 0.2901081 1.5605757 ] [ 1.7760803 2.8002478 1.800182 ] [ 3.1390093 2.8217558 3.8632534 ] [ 3.6390145 1.9926888 0.4495246 ] [ 5.1011632 1.8987766 2.4867465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4333027e-10 2.901081e-11 1.5605757e-10 ] [ 1.7760803e-10 2.8002478e-10 1.800182e-10 ] [ 3.1390093e-10 2.8217558e-10 3.8632534e-10 ] [ 3.6390145e-10 1.9926888e-10 4.495246e-11 ] [ 5.1011632e-10 1.8987766e-10 2.4867465e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.89e-05 -1.42e-05 -2.18e-05 ] [ -2.48e-05 4.69e-05 1.47e-05 ] [ -2.9e-06 2e-07 -1.2e-06 ] [ -7.4e-06 -3.31e-05 1.56e-05 ] [ 1.61e-05 1e-07 -7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.02811383826e-14 -2.27509082028e-14 -3.492745062119999e-14 ] [ -3.97339805232e-14 7.514208413459999e-14 2.35519965198e-14 ] [ -4.6463122386e-15 3.204353268e-16 -1.9226119608e-15 ] [ -1.18561070916e-14 -5.303204658539999e-14 2.49939554904e-14 ] [ 2.579504380739999e-14 1.602176634e-16 -1.16958894282e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.382973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.823753336605288e-18 } }