{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0901423 0.1544821 -1.3054117 ] [ 0.1451698 0.0803385 -0.6843405 ] [ 0.3233358 1.1100083 0.2311324 ] [ 0.0382422 -0.2926329 0.1873313 ] [ 0.0820734 -0.41373 0.8821886 ] [ -0.5883993 -0.2648695 1.4255431 ] [ -0.1410914 0.0273918 -1.0362722 ] [ 0.0505272 -0.4009884 0.2998291 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.444238856051398e-10 2.475076089520877e-10 -2.091500106258784e-09 ] [ 2.325876596062118e-10 1.287164664501408e-10 -1.096434349766583e-09 ] [ 5.180410594276646e-10 1.778429347153953e-09 3.703149275893939e-10 ] [ 6.127075876795776e-11 -4.688495908569042e-10 3.001378292040711e-10 ] [ 1.314960826695667e-10 -6.62868533323584e-10 1.413421950056283e-09 ] [ -9.427196021550854e-10 -4.243677204629856e-10 2.283971826762756e-09 ] [ -2.260533424759411e-10 4.388650156162944e-11 -1.660291091624982e-09 ] [ 8.095349855448577e-11 -6.424542396919987e-10 4.803791742555053e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 26.373463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.225494582813384e-18 } }