{ "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" [ [ 0.6678483 0.3705928 0.1642866 ] [ 0.4651457 2.25942 0.9775642 ] [ 2.325854 0.8972553 0.6909246 ] [ 2.51877 2.867173 0.7641457 ] [ 2.596702 2.283556 2.674442 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.678483e-11 3.705928e-11 1.642866e-11 ] [ 4.651457e-11 2.25942e-10 9.775642000000001e-11 ] [ 2.325854e-10 8.972553e-11 6.909246e-11 ] [ 2.51877e-10 2.867173e-10 7.641457000000001e-11 ] [ 2.596702e-10 2.283556e-10 2.674442e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2318094 -4.3547494 -2.6880361 ] [ -9.9470465 5.9400169 2.4604846 ] [ 10.3120368 -12.4504825 -4.4180177 ] [ 4.2095958 8.9928891 -4.8647452 ] [ 0.6572233 1.8723259 9.5103143 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.382282774221559e-09 -6.977077735605519e-09 -4.306708630768487e-09 ] [ -1.593692547961148e-08 9.516956282745113e-09 3.942130934436836e-09 ] [ 1.652170440990813e-08 -1.99478721435259e-08 -7.078444727538421e-09 ] [ 6.744516029344536e-09 1.440819678817329e-08 -7.794181089803656e-09 ] [ 1.052987814580372e-09 2.999796808213021e-09 1.523720335345606e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3354599 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.015052581742398e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3673662 0.1674212 0.1013574 ] [ 0.4845848 2.3116103 1.147119 ] [ 2.5988242 0.7565516 0.7165211 ] [ 2.7375262 3.2866366 0.4741406 ] [ 2.3860186 2.1557774 2.832225 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.673662e-11 1.674212e-11 1.013574e-11 ] [ 4.845848e-11 2.3116103e-10 1.147119e-10 ] [ 2.5988242e-10 7.565516e-11 7.165211000000001e-11 ] [ 2.7375262e-10 3.2866366e-10 4.741406000000001e-11 ] [ 2.3860186e-10 2.1557774e-10 2.832225000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -2.1e-06 1.1e-06 ] [ 6.7e-06 -1.12e-05 -8.6e-06 ] [ -1.7e-05 2.7e-06 1.5e-06 ] [ 3.6e-06 8.1e-06 4.9e-06 ] [ 6.7e-06 2.5e-06 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -3.364570931399999e-15 1.7623942974e-15 ] [ 1.07345834478e-14 -1.79443783008e-14 -1.37787190524e-14 ] [ -2.723700277799999e-14 4.3258769118e-15 2.403264951e-15 ] [ 5.767835882399999e-15 1.29776307354e-14 7.850665506599998e-15 ] [ 1.07345834478e-14 4.005441585e-15 1.7623942974e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.499658 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.483318988259117e-18 } }