{ "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" [ [ 0.1779892 2.357943 0.2667025 ] [ 0.683577 1.802827 2.30843 ] [ 1.994264 0.9284256 0.4445094 ] [ 2.959137 1.015728 2.327469 ] [ 2.670153 2.85418 1.122954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.779892e-11 2.357943e-10 2.667025e-11 ] [ 6.83577e-11 1.802827e-10 2.30843e-10 ] [ 1.994264e-10 9.284256e-11 4.445094e-11 ] [ 2.959137e-10 1.015728e-10 2.327469e-10 ] [ 2.670153e-10 2.85418e-10 1.122954e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4613217 0.7850544 -1.7919442 ] [ -1.1277054 -0.1929758 2.4956369 ] [ -0.8211029 -2.6760461 -3.5902256 ] [ 2.0150915 -1.5510034 3.335935 ] [ 1.3950385 3.6349709 -0.4494022 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.341295482497158e-09 1.257795816098889e-09 -2.871011126671823e-09 ] [ -1.806783241915623e-09 -3.091813176874572e-10 3.998451128128194e-09 ] [ -1.315551880489638e-09 -4.287498532926827e-09 -5.75217556710863e-09 ] [ 3.228532516672011e-09 -2.484981406734555e-09 5.34475710954279e-09 ] [ 2.235098088230409e-09 5.82386544124995e-09 -7.200217041081947e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.991911632689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.440663071288818e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.593078 2.4233848 0.3557076 ] [ 0.5061223 1.6736709 2.6156257 ] [ 1.8958637 0.4391629 0.1496131 ] [ 2.800968 1.1602571 2.2323166 ] [ 2.6890882 3.262628 1.116802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.93078e-11 2.4233848e-10 3.557076000000001e-11 ] [ 5.061223e-11 1.6736709e-10 2.6156257e-10 ] [ 1.8958637e-10 4.391629000000001e-11 1.496131e-11 ] [ 2.800968e-10 1.1602571e-10 2.2323166e-10 ] [ 2.6890882e-10 3.262628e-10 1.116802e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.16e-05 -3.02e-05 3.23e-05 ] [ -1.49e-05 5e-06 -2.51e-05 ] [ -1.51e-05 3.76e-05 1.13e-05 ] [ 7.6e-06 1.04e-05 -1.19e-05 ] [ -9.2e-06 -2.29e-05 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.06287816344e-14 -4.838573434679999e-14 5.17503052782e-14 ] [ -2.38724318466e-14 8.010883169999999e-15 -4.02146335134e-14 ] [ -2.41928671734e-14 6.024184143839999e-14 1.81045959642e-14 ] [ 1.21765424184e-14 1.66626369936e-14 -1.90659019446e-14 ] [ -1.47400250328e-14 -3.66898449186e-14 -1.07345834478e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }