{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.462385 1.450975 0.2684659 ] [ 3.060126 2.637643 2.086081 ] [ 2.184778 3.8492 0.5676389 ] [ 4.510071 4.418515 1.324556 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.462385e-10 1.450975e-10 2.684659e-11 ] [ 3.060126e-10 2.637643e-10 2.086081e-10 ] [ 2.184778e-10 3.849200000000001e-10 5.676389e-11 ] [ 4.510071e-10 4.418515e-10 1.324556e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3638953 -0.9561988 -0.9642034 ] [ 2.576668 -1.9111919 4.2637621 ] [ -1.5987037 3.1513423 -3.3391165 ] [ -0.6140691 -0.2839516 0.0395578 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.830245420790022e-10 -1.531999362197015e-09 -1.544824145175871e-09 ] [ 4.128277229163495e-09 -3.062066980042332e-09 6.831299953273112e-09 ] [ -2.561405691726457e-09 5.0490069571981e-09 -5.349854390427523e-09 ] [ -9.838471555756973e-10 -4.549406149587533e-10 6.337858233028223e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -8.7236235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397678562036147e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1788958 1.8100355 0.5875597 ] [ 3.7008039 2.2039798 2.2557707 ] [ 2.4078756 3.9741865 -0.1323991 ] [ 3.9297846 4.3681312 1.5358105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1788958e-10 1.8100355e-10 5.875597e-11 ] [ 3.7008039e-10 2.2039798e-10 2.2557707e-10 ] [ 2.4078756e-10 3.9741865e-10 -1.323991e-11 ] [ 3.9297846e-10 4.3681312e-10 1.5358105e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-06 4e-07 4.9e-06 ] [ -3.8e-06 1.03e-05 -1.02e-05 ] [ 3.2e-06 -8e-07 3.4e-06 ] [ -2.8e-06 -9.9e-06 2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-15 6.408706483200001e-16 7.850665441919999e-15 ] [ -6.08827115904e-15 1.650241919424e-14 -1.634220153216e-14 ] [ 5.126965186560001e-15 -1.28174129664e-15 5.44740051072e-15 ] [ -4.48609453824e-15 -1.586154854592e-14 3.2043532416e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.238204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.800558770858104e-18 } }