{ "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" [ [ 3.4094406 -1.8390715 2.7459785 ] [ -0.7475852 -0.1795951 0.467721 ] [ 1.7821826 -3.303259 1.7191299 ] [ 0.4111997 0.5853866 1.1941896 ] [ 0.7271469 0.2492449 -0.8375312 ] [ -1.5255112 1.6197768 -4.3474303 ] [ -1.0939549 -0.006176599999999996 0.7123221 ] [ -2.9629186 2.8736939 -1.6543795 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.462526019326325e-09 -2.946517361279587e-09 4.399542553919453e-09 ] [ -1.197763529496092e-09 -2.877430704302381e-10 7.493716512571967e-10 ] [ 2.855371295716558e-09 -5.292404342247188e-09 2.754349733898242e-09 ] [ 6.588145458199738e-10 9.378927246496013e-10 1.913302657922504e-09 ] [ 1.165017763067196e-09 3.993343516336339e-10 -1.341872907830569e-09 ] [ -2.444138379408553e-09 2.595168519874237e-09 -6.96535118721753e-09 ] [ -1.752708964989602e-09 -9.896004116033274e-12 1.14126581509916e-09 ] [ -4.747118910253466e-09 4.604165181915574e-09 -2.650608156830793e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.050397 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.013516041515846e-18 } }