{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.345813 0.4549735 0.1681533 ] [ -0.417987 0.4763515 -0.9609782 ] [ 0.2885827 0.0227487 0.5736732 ] [ -0.1679395 -0.2591342 -0.5415883 ] [ 0.6872319 0.323757 2.01822 ] [ -0.9522412 0.2388845 -0.5357369 ] [ -0.2880025 -0.4086828 -0.4179998 ] [ 0.5045426 -0.8488982 -0.3037434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.540535037687104e-10 7.289479047835488e-10 2.694112859703687e-10 ] [ -6.696889991983295e-10 7.631992365830112e-10 -1.539656805138467e-09 ] [ 4.623604551073402e-10 3.644743529359296e-11 9.191257890195225e-10 ] [ -2.690687406088416e-10 -4.151787568897113e-10 -8.677201123588167e-10 ] [ 1.101066883247964e-09 5.187158962203456e-10 3.233544899630976e-09 ] [ -1.525658588002537e-09 3.827351609714976e-10 -8.583451360798674e-10 ] [ -4.61430872231952e-10 -6.547820274830823e-10 -6.697095070590758e-10 ] [ 8.08366357917646e-10 -1.360084849479203e-09 -4.866505742023027e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -37.161866 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.953987289050242e-18 } }