{ "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" [ [ 5.469727 1.7850605 2.9602259 ] [ -0.4619936 -0.1800854 4.4737207 ] [ 4.7449334 4.4319089 -7.738009 ] [ -7.7445832 5.6833863 -5.1340671 ] [ -0.0893159 0.6751872 -1.9766531 ] [ -2.7427428 -3.9070786 0.0463233 ] [ 3.7900863 -3.6915804 2.7398697 ] [ -2.9661112 -4.7967985 4.6285896 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.76346872155852e-09 2.859982199813558e-09 4.742804729266639e-09 ] [ -7.401953448792269e-10 -2.885286176274163e-10 7.167690713529011e-09 ] [ 7.602221360733055e-09 7.100700825095445e-09 -1.239765711133999e-08 ] [ -1.240819014088045e-08 9.105788656835015e-09 -8.225682277238456e-09 ] [ -1.430998468457107e-10 1.081769146503414e-09 -3.166947384251844e-09 ] [ -4.39435839102753e-09 -6.259829988547995e-09 7.421810825830464e-11 ] [ 6.072387660674375e-09 -5.914563810683512e-09 4.38975517737831e-09 ] [ -4.752234019333033e-09 -7.68531841138851e-09 7.415818044398023e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 741.30009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.187693673194936e-16 } }