{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.887739 1.995765 3.859098 ] [ 2.327199 3.871069 1.984027 ] [ 1.151407 3.535975 3.566474 ] [ 2.937456 4.643275 4.143131 ] [ 3.294842 1.915913 1.493263 ] [ 5.055976 2.713207 3.11233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.887739e-10 1.995765e-10 3.859098e-10 ] [ 2.327199e-10 3.871069e-10 1.984027e-10 ] [ 1.151407e-10 3.535975e-10 3.566474e-10 ] [ 2.937456e-10 4.643275e-10 4.143131e-10 ] [ 3.294842e-10 1.915913e-10 1.493263e-10 ] [ 5.055976000000001e-10 2.713207e-10 3.11233e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1775254 -5.5625765 5.3715617 ] [ 9.148567 8.9325416 -26.7407005 ] [ -24.5490683 -8.0422393 16.6644981 ] [ 10.2159492 7.6939603 7.3789526 ] [ 1.9982376 -3.326555 -2.8783408 ] [ 3.3638399 0.3048688 0.2040289 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.844270478215035e-10 -8.912230093137499e-09 8.606190643829317e-09 ] [ 1.465762028198348e-08 1.431150943375297e-08 -4.284332551789211e-08 ] [ -3.933194361673009e-08 -1.288508789149652e-08 2.669946947315739e-08 ] [ 1.636775510237099e-08 1.232708341558363e-08 1.182238543911355e-08 ] [ 3.201529591900238e-09 -5.32972869271587e-09 -4.611610374448867e-09 ] [ 5.389465688296896e-09 4.884536677956192e-10 3.268903362407226e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1641672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.876084655909203e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8721234 1.7745404 4.1537446 ] [ 2.2967789 4.2322531 1.6241757 ] [ 1.0013601 3.3661469 3.5889984 ] [ 3.2462943 4.5008335 4.0493225 ] [ 3.2777926 1.9259747 1.5715825 ] [ 4.9602697 2.8754554 3.1704993 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8721234e-10 1.7745404e-10 4.153744599999999e-10 ] [ 2.2967789e-10 4.2322531e-10 1.6241757e-10 ] [ 1.0013601e-10 3.3661469e-10 3.5889984e-10 ] [ 3.2462943e-10 4.5008335e-10 4.0493225e-10 ] [ 3.2777926e-10 1.9259747e-10 1.5715825e-10 ] [ 4.960269699999999e-10 2.8754554e-10 3.1704993e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.05e-05 1.31e-05 -1.36e-05 ] [ 1.02e-05 1.05e-05 -1.8e-06 ] [ 7.3e-06 -2.53e-05 7.4e-06 ] [ 1.15e-05 -2.4e-06 -2.9e-06 ] [ -1.06e-05 -1.19e-05 9e-06 ] [ 2.1e-06 1.6e-05 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2844620997e-14 2.09885139054e-14 -2.17896022224e-14 ] [ 1.63422016668e-14 1.6822854657e-14 -2.8839179412e-15 ] [ 1.16958894282e-14 -4.053506884019999e-14 1.18561070916e-14 ] [ 1.8425031291e-14 -3.845223921599999e-15 -4.6463122386e-15 ] [ -1.69830723204e-14 -1.90659019446e-14 1.4419589706e-14 ] [ 3.364570931399999e-15 2.5634826144e-14 3.364570931399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.824633 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.535385723422532e-18 } }