{ "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" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.7106099 11.6972604 -3.0331868 ] [ -0.3938791 -1.356088 2.3108185 ] [ 12.15098 11.7870041 -15.7171774 ] [ -22.1394083 22.3590288 -15.9676507 ] [ -0.7690466 0.5482763 -0.2827507 ] [ -11.6362938 -10.3695399 10.9688825 ] [ 21.6577072 -20.1389828 15.958383 ] [ -11.5806692 -14.5269589 5.7626815 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.036464218566907e-08 1.874107729469349e-08 -4.859701017517231e-09 ] [ -6.310638906409493e-10 -2.172692507247792e-09 3.702339406114928e-09 ] [ 1.946801623620132e-08 1.88848625538822e-08 -2.518169438271287e-08 ] [ -3.547124266884566e-08 3.582311350229305e-08 -2.558299685141374e-08 ] [ -1.232148492977144e-09 8.784354768359742e-10 -4.530165647871438e-10 ] [ -1.864339803271907e-08 -1.661383453311069e-08 1.75740872425915e-08 ] [ 3.469947242185357e-08 -3.226620767468789e-08 2.556814835902282e-08 ] [ -1.855427759832347e-08 -2.327475411265834e-08 9.23283364848407e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.694583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.919374554973622e-19 } }