{ "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" [ [ 3.095423 1.998262 0.8352723 ] [ 3.003915 2.107064 3.861401 ] [ 2.921301 4.877628 0.9226955 ] [ 1.839297 3.508607 2.236053 ] [ 4.200263 0.9739816 2.537715 ] [ 4.333089 3.298954 2.357847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.095423e-10 1.998262e-10 8.352723e-11 ] [ 3.003915e-10 2.107064e-10 3.861401e-10 ] [ 2.921301e-10 4.877627999999999e-10 9.226955000000001e-11 ] [ 1.839297e-10 3.508607e-10 2.236053e-10 ] [ 4.200263e-10 9.739816e-11 2.537715e-10 ] [ 4.333089e-10 3.298954000000001e-10 2.357847e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7111998 -0.0346535 -2.1652935 ] [ -2.3516903 1.9983411 3.552861 ] [ 1.1491393 0.6767463 -0.5790024 ] [ -1.3585126 -1.0111846 0.9911033 ] [ 2.5488685 -2.8477182 -1.6437156 ] [ 0.723395 1.2184689 -0.1559527 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.139467692277636e-09 -5.552102752889279e-11 -3.469182622870205e-09 ] [ -3.767823218022138e-09 3.201695390803755e-09 5.692310831152109e-09 ] [ 1.841124120502478e-09 1.084267100072903e-09 -9.2766410866709e-10 ] [ -2.176577126782223e-09 -1.620096325433e-09 1.587922536057729e-09 ] [ 4.083737520193565e-09 -4.562547522666659e-09 -2.633522705564244e-09 ] [ 1.159006556603616e-09 1.952202384751893e-09 -2.498637698906362e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.245090279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.403561019130431e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6829448 2.0805467 0.5602853 ] [ 3.0058076 2.4244198 3.8783389 ] [ 3.2451699 4.2781972 1.095523 ] [ 1.4802833 3.2258298 2.195524 ] [ 4.2083771 1.2789336 2.2430886 ] [ 4.7707053 3.4765695 2.7782239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6829448e-10 2.0805467e-10 5.602853e-11 ] [ 3.0058076e-10 2.4244198e-10 3.8783389e-10 ] [ 3.2451699e-10 4.2781972e-10 1.095523e-10 ] [ 1.4802833e-10 3.2258298e-10 2.195524e-10 ] [ 4.2083771e-10 1.2789336e-10 2.2430886e-10 ] [ 4.770705300000001e-10 3.4765695e-10 2.7782239e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.95e-05 -3.86e-05 -3.64e-05 ] [ 3.99e-05 -1.2e-06 -1.88e-05 ] [ 3.49e-05 -1.07e-05 -1.89e-05 ] [ -5.21e-05 1.38e-05 1.39e-05 ] [ 1.03e-05 3.96e-05 -9.6e-06 ] [ 6.5e-06 -2.8e-06 6.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.32859765216e-14 -6.184401756288e-14 -5.831922899712e-14 ] [ 6.392684716992e-14 -1.92261194496e-15 -3.012092047104e-14 ] [ 5.591596406592e-14 -1.714328984256e-14 -3.028113813312e-14 ] [ -8.347340194367999e-14 2.211003736704e-14 2.227025502912e-14 ] [ 1.650241919424e-14 6.344619418368e-14 -1.538089555968e-14 ] [ 1.04141480352e-14 -4.48609453824e-15 1.1183192813184e-13 ] ] } "relaxed-potential-energy" { "source-value" -6.635338279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.063098386184439e-18 } }