{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.11618e-10 0.0 0.0 ] "source-value" [ 3.11618 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.45858e-11 3.14304e-10 0.0 ] "source-value" [ 0.145858 3.14304 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.74328e-12 -4.61774e-12 2.94713e-10 ] "source-value" [ 0.0274328 -0.0461774 2.94713 ] } "species" { "source-value" [ "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.326459928401031e-10 1.15709195554176e-10 -1.073915436925914e-09 ] [ -3.326459928401031e-10 -1.15709195554176e-10 1.073915436925914e-09 ] ] "source-value" [ [ 0.2076213 0.07222 -0.6702853 ] [ -0.2076213 -0.07222 0.6702853 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -2.51184e-13 -7.35309e-13 -7.044350000000001e-12 ] [ 1.57088e-10 1.49683e-10 1.55691e-10 ] ] "source-value" [ [ -0.00251184 -0.00735309 -0.0704435 ] [ 1.57088 1.49683 1.55691 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.312759876334232e-19 "source-value" -2.0676621 } }