{ "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" [ 5.21631 0 0 ] "si-unit" "m" "si-value" [ 5.21631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.340777 5.491 0 ] "si-unit" "m" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0764414 0.261433 5.31631 ] "si-unit" "m" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 27.9720958 -36.8217162 11.3196178 ] [ 0.0016536 -1.0675036 1.0576622 ] [ 1.5208341 -3.7234563 1.2835673 ] [ 1.6137838 -0.7036083 -2.3873522 ] [ -0.7022912 0.3569077 0.1111752 ] [ -20.2842958 31.9686486 -11.4900016 ] [ -6.3726192 6.565053 2.2888675 ] [ -3.7491612 3.425675 -2.1835363 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.481623829476954e-08 -5.899489331941926e-08 1.813602714497048e-08 ] [ 2.6493592819824e-12 -1.710329324630882e-09 1.694561663505035e-09 ] [ 2.436644859210419e-09 -5.965634681580094e-09 2.056501536226468e-09 ] [ 2.585566696687729e-09 -1.127304777748462e-09 -3.824959911968494e-09 ] [ -1.125194550903821e-09 5.718291774346817e-10 1.781223077202768e-10 ] [ -3.249902476790433e-08 5.121942180747681e-08 -1.840901208814261e-08 ] [ -1.021006157961977e-08 1.05183745175716e-08 3.667170026821995e-09 ] [ -6.006818471739401e-09 5.488536440677949e-09 -3.498410839350814e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.2898617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.167964608083152e-18 } }