{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8902865 -0.5678924 -0.287653 ] [ -3.8834662 1.5727905 -0.6695729 ] [ -1.6806637 -1.3538277 1.7395407 ] [ -1.3064551 0.5520877 1.1111748 ] [ 2.3992581 -0.4744916 -0.8789004 ] [ 3.029509 0.3507253 -1.2520017 ] [ 0.5515314 -0.0793918 0.2374124 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.426396216113859e-09 -9.098639264100018e-10 -4.608709115029824e-10 ] [ -6.221998753307017e-09 2.519888168516342e-09 -1.072774046301256e-09 ] [ -2.692720087567225e-09 -2.169071089531436e-09 2.787051440470067e-09 ] [ -2.093171817344926e-09 8.845420055712441e-10 1.780298286182116e-09 ] [ 3.844035235085029e-09 -7.602193482859853e-10 -1.408153672891768e-09 ] [ 4.853808492303188e-09 5.619238759830663e-10 -2.005927852941855e-09 ] [ 8.836507147170932e-10 -1.271996858432294e-10 3.803765967680179e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.706209158928928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.074453152863076e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.375769 2.6507132 1.2884963 ] [ 1.7787858 4.9221402 1.906128 ] [ 2.0900599 3.1634737 3.61575 ] [ 4.6143494 2.9907991 0.4957489 ] [ 4.427211 3.0384374 2.8511255 ] [ 4.1358795 5.1700947 1.3772744 ] [ 3.4795145 5.1521207 3.6858413 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.375769e-10 2.6507132e-10 1.2884963e-10 ] [ 1.7787858e-10 4.9221402e-10 1.906128e-10 ] [ 2.0900599e-10 3.1634737e-10 3.61575e-10 ] [ 4.6143494e-10 2.9907991e-10 4.957489e-11 ] [ 4.427211e-10 3.0384374e-10 2.8511255e-10 ] [ 4.1358795e-10 5.1700947e-10 1.3772744e-10 ] [ 3.4795145e-10 5.1521207e-10 3.6858413e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.87e-05 2.32e-05 -1.91e-05 ] [ -6.2e-06 -1.59e-05 -6.47e-05 ] [ 1.81e-05 -3.99e-05 4.86e-05 ] [ -1.59e-05 -4.8e-06 2.85e-05 ] [ 3.4e-05 2.04e-05 -2.47e-05 ] [ 4.29e-05 7.5e-06 2.1e-06 ] [ -1.41e-05 9.6e-06 2.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.404776764096e-14 3.717049760256e-14 -3.060157345728e-14 ] [ -9.93349504896e-15 -2.547460827072e-14 -1.0366082736576e-13 ] [ 2.899939683648e-14 -6.392684716992e-14 7.786578377088e-14 ] [ -2.547460827072e-14 -7.69044777984e-15 4.56620336928e-14 ] [ 5.44740051072e-14 3.268440306432e-14 -3.957376253376001e-14 ] [ 6.873337703232e-14 1.2016324656e-14 3.36457090368e-15 ] [ -2.259069035328e-14 1.538089555968e-14 4.678355732736e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }