{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.4232488 -3.0443035 3.560261 ] [ -0.9633692 -0.3568744 0.6251896 ] [ 2.6284806 -4.4426981 2.5283049 ] [ 0.5169567 0.5866374 1.9127476 ] [ 1.0190072 0.4568469 -1.102655 ] [ -2.2522115 2.5633122 -5.4373845 ] [ -1.2875526 0.3408226 0.6353588 ] [ -4.0845602 3.8962569 -2.7218224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.086825815341655e-09 -4.877511894319612e-09 5.704166938146029e-09 ] [ -1.543487609438799e-09 -5.717758202420275e-10 1.001664160687304e-09 ] [ 4.211290165546357e-09 -7.117987029092581e-09 4.050791001034082e-09 ] [ 8.282559387059195e-10 9.398967271668979e-10 3.06455948621131e-09 ] [ 1.63262951226687e-09 7.319494224649555e-10 -1.766648061808224e-09 ] [ -3.608440610396899e-09 4.106878878651414e-09 -8.711650324200297e-09 ] [ -2.062886673770254e-09 5.4605800156027e-10 1.017957015179543e-09 ] [ -6.544186858690172e-09 6.242491713810684e-09 -4.360840215249746e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.641671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.550207538164536e-18 } }