{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.3483726e-10 -3.9398145e-10 2.3789453e-10 ] [ -1.4361092e-10 2.3783055e-10 9.6127533e-10 ] [ -2.9235832e-10 3.944355600000001e-10 -2.0471613e-10 ] [ 2.4260886e-10 9.7599453e-10 4.0814992e-10 ] [ 7.0445988e-10 3.2213243e-10 -2.4124463e-10 ] [ 8.327110400000001e-10 1.9342187e-10 7.4210859e-10 ] ] "source-value" [ [ 1.3483726 -3.9398145 2.3789453 ] [ -1.4361092 2.3783055 9.6127533 ] [ -2.9235832 3.9443556 -2.0471613 ] [ 2.4260886 9.7599453 4.0814992 ] [ 7.0445988 3.2213243 -2.4124463 ] [ 8.3271104 1.9342187 7.4210859 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 -1.6021766208e-16 -1.6021766208e-16 ] [ -1.6021766208e-16 0.0 3.2043532416e-16 ] [ 0.0 0.0 0.0 ] [ 1.6021766208e-16 1.6021766208e-16 -1.6021766208e-16 ] [ -1.6021766208e-16 1.6021766208e-16 -9.6130597248e-16 ] [ 1.6021766208e-16 -1.6021766208e-16 9.6130597248e-16 ] ] "source-value" [ [ 0.0 -1e-07 -1e-07 ] [ -1e-07 -0.0 2e-07 ] [ 0.0 0.0 0.0 ] [ 1e-07 1e-07 -1e-07 ] [ -1e-07 1e-07 -6e-07 ] [ 1e-07 -1e-07 6e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "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" 4.78418879116424e-31 "source-value" 2.9860558e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.650745662790193e-09 -2.869675897087683e-08 -1.313563568464668e-09 ] [ -1.346709798939933e-08 -2.442687288043095e-09 2.477054601408137e-08 ] [ -2.09828795181753e-08 4.623316800152306e-09 -2.223832925668563e-08 ] [ -5.435421837214589e-09 3.041905541925041e-08 5.601177422784384e-09 ] [ 2.244410657337236e-08 7.004347685514815e-10 -2.400127997550603e-08 ] [ 2.609203843420705e-08 -4.603360889251931e-09 1.718144936379058e-08 ] ] "source-value" [ [ -5.3993708 -17.9111083 -0.8198619 ] [ -8.4055015 -1.5246055 15.4605589 ] [ -13.0964834 2.8856474 -13.8800735 ] [ -3.3925235 18.9860812 3.49598 ] [ 14.0085096 0.437177 -14.9804208 ] [ 16.2853696 -2.8731919 10.7238173 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.890010855079962e-17 "source-value" 117.9652 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] "source-value" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] } "instance-id" 1 }