{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.5020975 10.5695437 -15.2982582 ] [ 3.3621986 -4.3574733 20.8048248 ] [ 12.5407877 -6.3439658 -5.3672056 ] [ -11.8629093 13.4196332 -13.1048832 ] [ 11.4620205 -13.2877379 12.9655222 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.483709818786213e-08 1.693427580866393e-08 -2.451051162700189e-08 ] [ 5.386835991406491e-09 -6.981441847020224e-09 3.333300389440003e-08 ] [ 2.00925568593562e-08 -1.016415368791477e-08 -8.599211331346837e-09 ] [ -1.900647593513089e-08 2.150062257275149e-08 -2.099633748135469e-08 ] [ 1.836418127223033e-08 -2.128930300669809e-08 2.077305654530338e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.2748666245911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.966650432935807e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3082798 1.2005272 1.0429807 ] [ 0.6187407 0.0101268 2.8497204 ] [ 1.7926447 0.0685275 0.7525461 ] [ 1.6678115 2.4668113 0.8632981 ] [ 2.594793 1.2764915 2.6701063 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.082798e-11 1.2005272e-10 1.0429807e-10 ] [ 6.187407e-11 1.01268e-12 2.8497204e-10 ] [ 1.7926447e-10 6.852750000000001e-12 7.525461e-11 ] [ 1.6678115e-10 2.4668113e-10 8.632981e-11 ] [ 2.594793e-10 1.2764915e-10 2.6701063e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.27e-05 -3.08e-05 4.6e-06 ] [ 4e-07 3.57e-05 -1.23e-05 ] [ 4e-06 -2.5e-06 -1.01e-05 ] [ 1.06e-05 1.26e-05 9.4e-06 ] [ 7.7e-06 -1.5e-05 8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.636940929216e-14 -4.934703992064001e-14 7.370012455680001e-15 ] [ 6.408706483200001e-16 5.719770536256001e-14 -1.970677243584e-14 ] [ 6.4087064832e-15 -4.005441552e-15 -1.618198387008e-14 ] [ 1.698307218048e-14 2.018742542208e-14 1.506046023552e-14 ] [ 1.233675998016e-14 -2.4032649312e-14 1.345828361472e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }