{ "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" [ [ 0.7742052 0.6824645 0.5764372 ] [ 0.6127639 2.971614 0.4436307 ] [ 0.405499 2.567939 2.589337 ] [ 2.552542 1.167694 2.901906 ] [ 2.397264 1.657583 0.5767519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.742052e-11 6.824645e-11 5.764372e-11 ] [ 6.127639e-11 2.971614e-10 4.436307e-11 ] [ 4.05499e-11 2.567939e-10 2.589337e-10 ] [ 2.552542e-10 1.167694e-10 2.901906e-10 ] [ 2.397264e-10 1.657583e-10 5.767519e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -28.0958939 -24.2535822 -3.1877093 ] [ -5.1439222 10.7963395 -5.3843433 ] [ -2.9303004 1.3927831 8.9427987 ] [ 1.0843948 0.7333842 2.2364129 ] [ 35.0857217 11.3310754 -2.6071591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.501458434705733e-08 -3.885852237149103e-08 -5.107273314366734e-09 ] [ -8.241471888054101e-09 1.729764273711956e-08 -8.626668953621122e-09 ] [ -4.694858792800889e-09 2.231484520665349e-09 1.432794300166063e-08 ] [ 1.737391996277092e-09 1.175011019304111e-09 3.583128462835528e-09 ] [ 5.621352303163523e-08 1.815438409440201e-08 -4.177129356725969e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.56580037 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.065121248539899e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.4296186 0.2909416 0.0614589 ] [ 0.6184261 2.928268 0.5172537 ] [ 0.450534 2.7394716 2.9663027 ] [ 2.5497438 1.4426191 2.9962188 ] [ 2.6939516 1.6459942 0.5468286 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.296186e-11 2.909416e-11 6.14589e-12 ] [ 6.184261e-11 2.928268e-10 5.172537000000001e-11 ] [ 4.50534e-11 2.7394716e-10 2.9663027e-10 ] [ 2.5497438e-10 1.4426191e-10 2.9962188e-10 ] [ 2.6939516e-10 1.6459942e-10 5.468286e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.72e-05 -7e-07 -1.5e-06 ] [ -1.76e-05 -2.7e-06 3.21e-05 ] [ 5.3e-06 2.34e-05 -4.03e-05 ] [ 9.8e-06 -2.27e-05 -1.21e-05 ] [ -1.46e-05 2.7e-06 2.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.755743787776e-14 -1.12152363456e-15 -2.4032649312e-15 ] [ -2.819830852608e-14 -4.32587687616e-15 5.142986952768e-14 ] [ 8.491536090240001e-15 3.749093292672001e-14 -6.456771781824e-14 ] [ 1.570133088384e-14 -3.636940929216e-14 -1.938633711168e-14 ] [ -2.339177866368e-14 4.32587687616e-15 3.508766799552e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.065358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.933083450918225e-18 } }