{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0144274e-10 2.80184e-10 2.8368009e-10 ] [ 3.9724297e-10 2.8696422e-10 1.5325057e-10 ] [ 3.6349009e-10 1.1114878e-10 3.0585504e-10 ] ] "source-value" [ [ 2.0144274 2.80184 2.8368009 ] [ 3.9724297 2.8696422 1.5325057 ] [ 3.6349009 1.1114878 3.0585504 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.008826531052928e-11 4.46734907177664e-12 -9.78817762945344e-12 ] [ -1.376157564903744e-11 2.8727026810944e-13 8.598080835523199e-12 ] [ 3.67331033850816e-12 -4.754459122224001e-12 1.19025701159232e-12 ] ] "source-value" [ [ 0.0062966 0.0027883 -0.0061093 ] [ -0.0085893 0.0001793 0.0053665 ] [ 0.0022927 -0.0029675 0.0007429 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.106978546478093e-18 "source-value" -6.9092167 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.675609602007949e-10 -8.863026374598413e-10 9.59735839391616e-10 ] [ 1.674335771882915e-09 2.384883479264886e-09 -2.848994792983436e-09 ] [ -1.206774971899782e-09 -1.498580841805044e-09 1.88925895359182e-09 ] ] "source-value" [ [ -0.2918286 -0.5531866 0.59902 ] [ 1.0450382 1.4885272 -1.7782027 ] [ -0.7532097 -0.9353406 1.1791827 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.0681068897831e-18 "source-value" -6.6665989 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.987433e-10 2.877912e-10 2.797409e-10 ] [ 3.916588e-10 2.799592e-10 1.620454e-10 ] [ 3.717737e-10 1.105466e-10 3.009994e-10 ] ] "source-value" [ [ 1.987433 2.877912 2.797409 ] [ 3.916588 2.799592 1.620454 ] [ 3.717737 1.105466 3.009994 ] ] } "instance-id" 1 }