{ "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" [ [ 3.8387395 -0.5644464 2.9492882 ] [ -1.5138945 -0.448804 0.5255555 ] [ 1.3800792 -3.5763075 1.0135855 ] [ 0.4007268 0.6572579 1.3607192 ] [ 1.4596128 0.2125745 -1.4650552 ] [ -0.7953739 0.8966396 -5.158543 ] [ -1.3221133 -0.0944875 1.0516737 ] [ -3.4477766 2.9175734 -0.2772238 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.150338680241482e-09 -9.043428257747251e-10 4.725280602041314e-09 ] [ -2.425526374257706e-09 -7.190632761215232e-10 8.420327350328544e-10 ] [ 2.211130629092367e-09 -5.729876265291696e-09 1.623942991281878e-09 ] [ 6.420351102879974e-10 1.053043241216104e-09 2.18011248971368e-09 ] [ 2.338557503580426e-09 3.405818940782496e-10 -2.347277189621468e-09 ] [ -1.274329467374517e-09 1.436575004403464e-09 -8.264896991991494e-09 ] [ -2.118259019308737e-09 -1.5138566345784e-10 1.684967014850233e-09 ] [ -5.523947062261314e-09 4.674467890947967e-09 -4.44161491089335e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.972218 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.603167005712094e-18 } }