{ "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" [ [ 0.9192407 0.3679632 0.2084149 ] [ 0.7009294 0.9640354 2.373703 ] [ 0.5234459 2.737555 0.0024849 ] [ 2.754814 0.6958427 0.7664459 ] [ 2.641472 1.152124 2.712512 ] [ 2.849889 2.552424 1.475764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.192407e-11 3.679632e-11 2.084149e-11 ] [ 7.009294e-11 9.640354e-11 2.373703e-10 ] [ 5.234459e-11 2.737555e-10 2.4849e-13 ] [ 2.754814e-10 6.958427e-11 7.664459e-11 ] [ 2.641472e-10 1.152124e-10 2.712512e-10 ] [ 2.849889e-10 2.552424e-10 1.475764e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.8015266 -6.6074504 -11.138052 ] [ -20.5961654 -3.7228483 10.9327273 ] [ -1.7704854 3.4564524 -1.8073239 ] [ 17.7062161 -13.378192 -16.2018592 ] [ 8.8369933 -5.3560843 24.2138772 ] [ 8.624968 25.6081225 -5.9993693 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.051030662906932e-08 -1.058630255397561e-08 -1.784512651565468e-08 ] [ -3.299869468200988e-08 -5.964660509045025e-09 1.751616008164191e-08 ] [ -2.836630315347737e-09 5.53784722618805e-09 -2.895652098793078e-09 ] [ 2.836848547825256e-08 -2.143422645097359e-08 -2.595824002373339e-08 ] [ 1.415842406342624e-08 -8.581393044493935e-09 3.879490794876216e-08 ] [ 1.381872208474813e-08 4.102873517208245e-08 -9.61204923200526e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.8514528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.170707632274699e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8563327 0.2394673 0.0119044 ] [ 0.2627631 1.0019321 2.4243743 ] [ 0.5734001 2.76762 0.5430135 ] [ 3.1912629 0.3900853 0.5388377 ] [ 2.597694 1.1525878 2.9512898 ] [ 2.9083382 2.9182519 1.069905 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.563326999999999e-11 2.394673e-11 1.19044e-12 ] [ 2.627631e-11 1.0019321e-10 2.4243743e-10 ] [ 5.734001e-11 2.76762e-10 5.430135000000001e-11 ] [ 3.1912629e-10 3.900853e-11 5.388377e-11 ] [ 2.597694e-10 1.1525878e-10 2.9512898e-10 ] [ 2.9083382e-10 2.9182519e-10 1.069905e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.12e-05 -2.7e-06 2.1e-05 ] [ 1.78e-05 1.04e-05 1.33e-05 ] [ 2.77e-05 1.9e-06 -9.7e-06 ] [ -2.24e-05 1.01e-05 -2.27e-05 ] [ -2.61e-05 -1.35e-05 -4.6e-06 ] [ -2.83e-05 -6.3e-06 2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.998791056896e-14 -4.32587687616e-15 3.36457090368e-14 ] [ 2.851874385024e-14 1.666263685632e-14 2.130894905664e-14 ] [ 4.438029239616e-14 3.04413557952e-15 -1.554111322176e-14 ] [ -3.588875630592e-14 1.618198387008e-14 -3.636940929216e-14 ] [ -4.181680980288e-14 -2.16293843808e-14 -7.370012455680001e-15 ] [ -4.534159836864e-14 -1.009371271104e-14 4.32587687616e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.187542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273094809901807e-18 } }