{ "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" [ [ -1.910954 -0.609488 -0.7397979 ] [ 0.2668497 -1.558506 0.5058358 ] [ 1.0409592 0.5224922 -0.5877503 ] [ -0.5698077 0.692303 1.2049551 ] [ 0.3775559 -1.1077637 -4.4666419 ] [ 0.6580771 2.2378962 0.7728205 ] [ 0.1373198 -0.1769338 3.3105788 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.061685822224243e-09 -9.765074242581505e-10 -1.185286899496936e-09 ] [ 4.275403506074938e-10 -2.497001876576525e-09 8.104382927236645e-10 ] [ 1.667800493446672e-09 8.371247873903577e-10 -9.416797895281862e-10 ] [ -9.129325752918202e-10 1.109191681109703e-09 1.930550890333726e-09 ] [ 6.049112360251028e-10 -1.774833101510905e-09 -7.156349225665692e-09 ] [ 1.054355744303864e-09 3.585504971417161e-09 1.238194937174966e-09 ] [ 2.200105731329318e-10 -2.83479197789303e-10 5.30413195467612e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4023981589289285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.025777264728889e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5421045 2.8873283 2.5696697 ] [ 2.3768081 1.8868705 1.5018154 ] [ 2.5185423 2.4124909 3.831592 ] [ 1.5961175 4.8049784 3.5024503 ] [ 4.0843621 3.4481211 2.0542453 ] [ 3.4372181 5.7110131 2.3195194 ] [ 3.8800081 4.4475878 4.2640498 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.421045e-11 2.8873283e-10 2.5696697e-10 ] [ 2.3768081e-10 1.8868705e-10 1.5018154e-10 ] [ 2.5185423e-10 2.4124909e-10 3.831592e-10 ] [ 1.5961175e-10 4.8049784e-10 3.5024503e-10 ] [ 4.0843621e-10 3.4481211e-10 2.0542453e-10 ] [ 3.4372181e-10 5.7110131e-10 2.3195194e-10 ] [ 3.8800081e-10 4.4475878e-10 4.264049799999999e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.24e-05 4.7e-06 -3e-06 ] [ 4e-07 2.2e-06 4.7e-06 ] [ -2.7e-06 4e-06 -4.42e-05 ] [ -3.5e-06 4.28e-05 1.95e-05 ] [ 8.3e-06 -3.01e-05 1.6e-05 ] [ -4.18e-05 -4.44e-05 2.47e-05 ] [ 6.9e-06 2.09e-05 -1.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.191052251392001e-14 7.53023011776e-15 -4.8065298624e-15 ] [ 6.408706483200001e-16 3.52478856576e-15 7.53023011776e-15 ] [ -4.32587687616e-15 6.4087064832e-15 -7.081620663936001e-14 ] [ -5.6076181728e-15 6.857315937023999e-14 3.12424441056e-14 ] [ 1.329806595264e-14 -4.822551628608e-14 2.56348259328e-14 ] [ -6.697098274944e-14 -7.113664196352e-14 3.957376253376001e-14 ] [ 1.105501868352e-14 3.348549137472e-14 -2.851874385024e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.968453158928927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.276686935517584e-18 } }