{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9684718 -7.0956376 1.8656537 ] [ -3.4544879 0.9504561 -6.9821189 ] [ -3.733081 4.4188618 5.4439862 ] [ 5.9465807 -4.481618 1.210091 ] [ 4.20946 6.2079377 -1.537612 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.756016117464093e-09 -1.136846467238942e-08 2.989106740649017e-09 ] [ -5.534699750216489e-09 1.522798542516747e-09 -1.118658766522581e-08 ] [ -5.981055101752685e-09 7.079797066506206e-09 8.722227413597833e-09 ] [ 9.527472571240498e-09 -7.180343582956455e-09 1.938779509240493e-09 ] [ 6.744298398192768e-09 9.946212646322923e-09 -2.463525998261529e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 31.419403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.033943292609339e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.6736332 -3.0997546 3.1869393 ] [ -1.3211059 1.9093157 -2.185823 ] [ -1.498247 3.9503546 5.2599932 ] [ 5.4277134 -1.2675469 2.7007391 ] [ 4.1435888 5.7420061 0.9008255 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.6736332e-10 -3.0997546e-10 3.1869393e-10 ] [ -1.3211059e-10 1.9093157e-10 -2.185823e-10 ] [ -1.498247e-10 3.9503546e-10 5.2599932e-10 ] [ 5.427713400000001e-10 -1.2675469e-10 2.7007391e-10 ] [ 4.1435888e-10 5.742006100000001e-10 9.008255e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 8.8817842e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.423018699623083e-34 } }