{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.973948e-11 2.8679866e-10 1.7366093e-10 ] [ 1.9538216e-10 4.9431907e-10 1.7094384e-10 ] [ 3.2142122e-10 3.0976917e-10 1.2315923e-10 ] ] "source-value" [ [ 0.9973948 2.8679866 1.7366093 ] [ 1.9538216 4.9431907 1.7094384 ] [ 3.2142122 3.0976917 1.2315923 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.3442261848512e-12 -1.20451638351744e-12 2.034764308416e-13 ] [ 1.2264662032224e-12 7.77055661088e-14 -2.8422613252992e-13 ] [ 1.1759976396672e-13 1.12681081740864e-12 8.074970168832e-14 ] ] "source-value" [ [ -0.000839 -0.0007518 0.000127 ] [ 0.0007655 4.85e-05 -0.0001774 ] [ 7.34e-05 0.0007033 5.04e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.509466686659174e-18 "source-value" -9.4213501 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.910792187206651e-09 -3.508735396890233e-09 -1.030851492841404e-09 ] [ 4.794518504491525e-09 6.068317651404556e-10 -1.081628956049094e-09 ] [ -7.705310691698175e-09 2.901903631749777e-09 2.112480448890498e-09 ] ] "source-value" [ [ 1.8167736 -2.1899804 -0.6434069 ] [ 2.9925031 0.3787546 -0.6750997 ] [ -4.8092767 1.8112258 1.3185066 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.184904700264045e-18 "source-value" -7.3955935 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.811497e-11 3.041926e-10 1.804822e-10 ] [ 1.764205e-10 4.847879e-10 1.745333e-10 ] [ 3.620074e-10 3.019064e-10 1.127485e-10 ] ] "source-value" [ [ 0.7811497 3.041926 1.804822 ] [ 1.764205 4.847879 1.745333 ] [ 3.620074 3.019064 1.127485 ] ] } "instance-id" 1 }