{ "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" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.8750515 7.2300865 2.5196343 ] [ 31.4161056 -30.6694144 -33.6510308 ] [ -29.8794816 -5.5598293 42.4954714 ] [ -5.6758011 17.1032858 -27.0054916 ] [ 15.0142286 11.8958714 15.6414167 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.742375340684665e-08 1.158387565209884e-08 4.036899201684946e-09 ] [ 5.033415032359655e-08 -4.913781913014312e-08 -5.391489525777433e-08 ] [ -4.787220725555293e-08 -8.907828593488574e-09 6.808525132789526e-08 ] [ -9.093635901651496e-09 2.740248487338399e-08 -4.326756763120327e-08 ] [ 2.405544624045453e-08 1.905928719814887e-08 2.506031235939738e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 17.481471 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.800840436414861e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.284221 2.957957 2.0833588 ] [ 2.3393152 0.1636252 0.6944979 ] [ 1.613882 0.9082774 2.8645704 ] [ 2.1911712 2.5492391 0.4172355 ] [ 2.7674812 3.1990281 2.8307638 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84221e-11 2.957957e-10 2.0833588e-10 ] [ 2.3393152e-10 1.636252e-11 6.944979e-11 ] [ 1.613882e-10 9.082774e-11 2.8645704e-10 ] [ 2.1911712e-10 2.5492391e-10 4.172355e-11 ] [ 2.767481200000001e-10 3.1990281e-10 2.8307638e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 -2.5e-06 -1.8e-06 ] [ -9e-07 0.0 5e-07 ] [ -7e-07 9e-07 -2.2e-06 ] [ -6e-07 8e-07 5.9e-06 ] [ 2.5e-06 9e-07 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.806529901999999e-16 -4.005441585e-15 -2.8839179412e-15 ] [ -1.4419589706e-15 0.0 8.010883169999999e-16 ] [ -1.1215236438e-15 1.4419589706e-15 -3.5247885948e-15 ] [ -9.613059803999998e-16 1.2817413072e-15 9.452842140600001e-15 ] [ 4.005441585e-15 1.4419589706e-15 -3.845223921599999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.744302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.721426961303947e-18 } }