{ "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" [ [ 1.922149 2.490454 3.411092 ] [ 2.441615 3.416271 1.506229 ] [ 2.671317 4.814549 3.971801 ] [ 3.703717 1.527403 2.621349 ] [ 3.855488 2.690161 4.660198 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.922149e-10 2.490454e-10 3.411092e-10 ] [ 2.441615e-10 3.416271e-10 1.506229e-10 ] [ 2.671317e-10 4.814549e-10 3.971801e-10 ] [ 3.703717e-10 1.527403e-10 2.621349e-10 ] [ 3.855488e-10 2.690161e-10 4.660198e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7033734 -1.6054688 3.3370338 ] [ -0.3493284 3.616656 -6.0821385 ] [ 0.1271977 3.3564285 0.7996966 ] [ 6.1801497 -6.2742458 -3.8392588 ] [ 4.7453544 0.9066301 5.7846668 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.714869462517261e-08 -2.572244576783831e-09 5.346517537179383e-09 ] [ -5.596857954614708e-10 5.794521688676045e-09 -9.74466010916758e-09 ] [ 2.037931811595321e-10 5.377591272086812e-09 1.281255196253249e-09 ] [ 9.901691362384135e-09 -1.005244993391259e-08 -6.151170690560664e-09 ] [ 7.602895877090413e-09 1.452581549933566e-09 9.268057906077949e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.276226 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.00556225640571e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2584821 2.2455304 3.7045762 ] [ 3.1614122 3.7432408 1.5313405 ] [ 2.4299252 4.4479752 3.8123327 ] [ 3.4077891 1.5275603 2.655935 ] [ 4.3366774 2.9745314 4.4664845 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2584821e-10 2.2455304e-10 3.7045762e-10 ] [ 3.1614122e-10 3.7432408e-10 1.5313405e-10 ] [ 2.4299252e-10 4.4479752e-10 3.8123327e-10 ] [ 3.4077891e-10 1.5275603e-10 2.655935e-10 ] [ 4.3366774e-10 2.9745314e-10 4.4664845e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 -3e-07 2.1e-06 ] [ 1.8e-06 -1.2e-06 -6.1e-06 ] [ -3e-07 2.4e-06 5.5e-06 ] [ 1.5e-06 -5.4e-06 -7e-06 ] [ 2.6e-06 4.5e-06 5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 -4.8065298624e-16 3.36457090368e-15 ] [ 2.88391791744e-15 -1.92261194496e-15 -9.77327738688e-15 ] [ -4.8065298624e-16 3.84522388992e-15 8.8119714144e-15 ] [ 2.4032649312e-15 -8.65175375232e-15 -1.12152363456e-14 ] [ 4.16565921408e-15 7.2097947936e-15 8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }