{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8333643 0.3795455 -1.5312247 ] [ 1.5146819 -2.065473 -1.3443786 ] [ 1.0959357 0.8586464 1.7862798 ] [ 0.4179671 -1.4785514 0.789348 ] [ -1.0739701 -2.0962945 -3.0123901 ] [ 1.6184576 4.6983323 0.512547 ] [ -0.7397078 -0.2962052 2.7998185 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.539550077069766e-09 6.080989316398469e-10 -2.453292435743659e-09 ] [ 2.426787948122725e-09 -3.309252578757881e-09 -2.153931980169632e-09 ] [ 1.755882570906434e-09 1.375703198948217e-09 2.861935757346193e-09 ] [ 6.696571214007414e-10 -2.368900505247987e-09 1.264674921694632e-09 ] [ -1.720689799834643e-09 -3.358634065882713e-09 -4.826381030712923e-09 ] [ 2.593054949839718e-09 7.527558229827477e-09 8.211908272267979e-10 ] [ -1.185142553147545e-09 -4.745730503092968e-10 4.485803780140929e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.99059006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.561974976588158e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7033062 2.6582633 2.3605322 ] [ 2.8901962 1.7747774 1.842124 ] [ 1.9641949 2.6403491 4.4827051 ] [ 1.7801219 4.7121527 3.1261597 ] [ 3.4597939 4.0048508 1.54809 ] [ 3.7311897 5.949676 2.8177943 ] [ 3.9063581 3.8583207 3.8659367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.033062e-11 2.6582633e-10 2.360532200000001e-10 ] [ 2.8901962e-10 1.7747774e-10 1.842124e-10 ] [ 1.9641949e-10 2.6403491e-10 4.4827051e-10 ] [ 1.7801219e-10 4.7121527e-10 3.1261597e-10 ] [ 3.459793900000001e-10 4.0048508e-10 1.54809e-10 ] [ 3.7311897e-10 5.949676e-10 2.8177943e-10 ] [ 3.9063581e-10 3.8583207e-10 3.8659367e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-05 -3.98e-05 -5.7e-06 ] [ 1.22e-05 7.61e-05 -1e-06 ] [ -1.7e-06 1.84e-05 3.08e-05 ] [ 8.17e-05 4.33e-05 1.39e-05 ] [ 3.2e-06 9.6e-06 -8.7e-06 ] [ -4.5e-05 -0.0001091 -2.1e-06 ] [ -6.33e-05 1.5e-06 -2.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.082829624199999e-14 -6.376663003319999e-14 -9.1324068138e-15 ] [ 1.95465549348e-14 1.219256418474e-13 -1.602176634e-15 ] [ -2.7237002778e-15 2.94800500656e-14 4.93470403272e-14 ] [ 1.308978309978e-13 6.93742482522e-14 2.22702552126e-14 ] [ 5.1269652288e-15 1.53808956864e-14 -1.39389367158e-14 ] [ -7.209794852999999e-14 -1.747974707694e-13 -3.364570931399999e-15 ] [ -1.014177809322e-13 2.403264951e-15 -4.35792044448e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.03147506491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.888960802556267e-18 } }