{ "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" [ [ 2.060429 2.678734 2.453953 ] [ 2.544795 1.257014 4.108114 ] [ 3.849483 1.551428 2.063601 ] [ 4.178567 2.654376 4.014408 ] [ 4.257126 3.923601 2.295059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.060429e-10 2.678734e-10 2.453953e-10 ] [ 2.544795e-10 1.257014e-10 4.108114e-10 ] [ 3.849483e-10 1.551428e-10 2.063601e-10 ] [ 4.178567e-10 2.654376e-10 4.014408000000001e-10 ] [ 4.257126000000001e-10 3.923601e-10 2.295059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8646639 6.6031007 -5.8986507 ] [ -5.2766099 -7.3479083 5.3273003 ] [ 7.1656708 -9.9442374 -9.6308788 ] [ 11.8028922 3.6856265 15.4565611 ] [ 2.1727108 7.0034184 -5.2543318 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.541799359742975e-08 1.057933356632811e-08 -9.450680245805555e-09 ] [ -8.454061018861828e-09 -1.177264689004227e-08 8.535275992640828e-09 ] [ 1.148067022810923e-08 -1.593242467396498e-08 -1.543036885111836e-08 ] [ 1.891031794066268e-08 5.905024611300932e-09 2.476414083238673e-08 ] [ 3.481066447519665e-09 1.122071322616054e-08 -8.418367567885981e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.487527 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.189810844608762e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.34244 2.4721427 2.904789 ] [ 1.6789401 1.068091 4.087284 ] [ 4.3784765 0.7281379 1.2640753 ] [ 4.7907791 3.321195 4.0712695 ] [ 4.6997642 4.4755863 2.6077173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.34244e-10 2.4721427e-10 2.904789e-10 ] [ 1.6789401e-10 1.068091e-10 4.087284000000001e-10 ] [ 4.3784765e-10 7.281379000000001e-11 1.2640753e-10 ] [ 4.790779100000001e-10 3.321195e-10 4.0712695e-10 ] [ 4.699764199999999e-10 4.4755863e-10 2.6077173e-10 ] ] } "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" -21.568291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.455621159081105e-18 } }