{ "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" [ [ 0.7742052 0.6824645 0.5764372 ] [ 0.6127639 2.971614 0.4436307 ] [ 0.405499 2.567939 2.589337 ] [ 2.552542 1.167694 2.901906 ] [ 2.397264 1.657583 0.5767519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.742052e-11 6.824645e-11 5.764372e-11 ] [ 6.127639e-11 2.971614e-10 4.436307e-11 ] [ 4.05499e-11 2.567939e-10 2.589337e-10 ] [ 2.552542e-10 1.167694e-10 2.901906e-10 ] [ 2.397264e-10 1.657583e-10 5.767519e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.6787162 -25.1758315 -12.6129169 ] [ -7.9381649 16.9990183 -6.326866 ] [ -11.8310812 10.3189771 20.5573611 ] [ 6.4448559 -0.1249007 9.1398427 ] [ 28.0031064 -2.0172632 -10.7574209 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.351789591899822e-08 -4.03361286385002e-08 -2.020812057727321e-08 ] [ -1.271834221483517e-08 2.723542969681136e-08 -1.013675678813441e-08 ] [ -1.895548169742641e-08 1.653282386019058e-08 3.293652333976337e-08 ] [ 1.032579744740494e-08 -2.001129814615546e-10 1.464364229172955e-08 ] [ 4.486592238385485e-08 -3.232011937040195e-09 -1.723528826608529e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.073117 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.133238269358303e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9687469 1.1059318 -0.4164949 ] [ -0.3590231 2.6347699 0.7800757 ] [ 0.6727196 3.0228179 2.8578279 ] [ 2.6383165 1.7340613 2.9452403 ] [ 2.8215142 0.5497136 0.9214137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.687469e-11 1.1059318e-10 -4.164949e-11 ] [ -3.590231e-11 2.6347699e-10 7.800757e-11 ] [ 6.727196e-11 3.0228179e-10 2.8578279e-10 ] [ 2.6383165e-10 1.7340613e-10 2.9452403e-10 ] [ 2.8215142e-10 5.497136e-11 9.214137000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.45e-05 -5.3e-06 -4.93e-05 ] [ -5.3e-05 2.18e-05 4.4e-05 ] [ -4.03e-05 2.44e-05 -1.08e-05 ] [ 5.64e-05 5.6e-06 2.09e-05 ] [ -1.76e-05 -4.65e-05 -4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.731862583360001e-14 -8.491536090240001e-15 -7.898730740544e-14 ] [ -8.49153609024e-14 3.492745033344e-14 7.04957713152e-14 ] [ -6.456771781824e-14 3.909310954752e-14 -1.730350750464e-14 ] [ 9.036276141312001e-14 8.972189076479999e-15 3.348549137472e-14 ] [ -2.819830852608e-14 -7.45012128672e-14 -7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }