{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6677845 -4.9654866 -10.4401599 ] [ -0.592184 -9.4960852 16.1800698 ] [ -5.2416567 -2.7814426 -0.2394187 ] [ -4.3068898 10.3387222 0.9711618 ] [ 10.8085151 6.9042922 -6.4716529 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.069908713632618e-09 -7.955586541415682e-09 -1.672698010919367e-08 ] [ -9.487833600118272e-10 -1.521440569656489e-08 2.592332955647213e-08 ] [ -8.39805981899968e-09 -4.456362305817167e-09 -3.83591043722329e-10 ] [ -6.900398145921988e-09 1.656445899778594e-08 1.555972730974045e-09 ] [ 1.731715019878377e-08 1.10618955460118e-08 -1.036873097431252e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3568459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.776083399808335e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5495279 1.9625728 1.9678365 ] [ 3.4449484 2.3878316 4.8598998 ] [ -0.3536113 2.4944552 2.9509212 ] [ 0.7990634 4.2521709 3.6191346 ] [ 4.3245059 3.5062864 3.6370039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5495279e-10 1.9625728e-10 1.9678365e-10 ] [ 3.4449484e-10 2.3878316e-10 4.8598998e-10 ] [ -3.536113e-11 2.4944552e-10 2.9509212e-10 ] [ 7.990634e-11 4.252170900000001e-10 3.619134600000001e-10 ] [ 4.3245059e-10 3.5062864e-10 3.6370039e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0098918 0.04122 0.0216135 ] [ 0.2062663 0.2622905 -0.2867831 ] [ -0.0485432 -0.0275384 0.0001017 ] [ 0.0386514 -0.0136815 -0.0217152 ] [ -0.2062663 -0.2622905 0.2867831 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.584841069762944e-11 6.6041720309376e-11 3.46286443936608e-11 ] [ 3.304750435189191e-10 4.202357069579423e-10 -4.594771780605485e-10 ] [ -7.777478013881856e-11 -4.412138065423872e-11 1.6294136233536e-13 ] [ 6.192636944118913e-11 -2.19201794374752e-11 -3.479158575599616e-11 ] [ -3.304750435189191e-10 -4.202357069579423e-10 4.594771780605485e-10 ] ] } "relaxed-potential-energy" { "source-value" -19.13294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.065434915516916e-18 } }