{ "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" [ 5.43856 0 0 ] "si-unit" "m" "si-value" [ 5.43856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00547847 5.34673 0 ] "si-unit" "m" "si-value" [ -5.47847e-13 5.34673e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698619 0.130192 5.52638 ] "si-unit" "m" "si-value" [ -6.986190000000001e-12 1.30192e-11 5.526379999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0176967 -0.0436428 -0.0335652 ] [ 1.35227 1.24207 1.37266 ] [ -0.0530244 2.758 2.7242 ] [ 1.3158 4.14206 3.88387 ] [ 2.73162 0.0656859 2.694 ] [ 4.07939 1.42095 3.99542 ] [ 2.69114 2.74306 -0.00706676 ] [ 4.05369 4.20359 1.27338 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.76967e-12 -4.36428e-12 -3.35652e-12 ] [ 1.35227e-10 1.24207e-10 1.37266e-10 ] [ -5.30244e-12 2.758e-10 2.7242e-10 ] [ 1.3158e-10 4.14206e-10 3.88387e-10 ] [ 2.73162e-10 6.568590000000001e-12 2.694e-10 ] [ 4.07939e-10 1.42095e-10 3.99542e-10 ] [ 2.69114e-10 2.74306e-10 -7.06676e-13 ] [ 4.05369e-10 4.20359e-10 1.27338e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2525327 0.7937457 -1.6575862 ] [ -0.5345285 1.9014876 -0.5460804 ] [ 0.3194893 -0.146771 -1.8336587 ] [ -0.2604964 -0.363984 2.7003368 ] [ 0.3738254 0.2876952 -0.3824976 ] [ -0.9686165 0.4790391 1.7862523 ] [ 0.266741 -0.715421 -1.078094 ] [ -0.4489471 -2.2357917 1.0113277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.0067786087275e-09 1.271720803400531e-09 -2.655745856600713e-09 ] [ -8.564090658512927e-10 3.046518977461102e-09 -8.749172499571123e-10 ] [ 5.118782870557574e-10 -2.351530648114368e-10 -2.937845099666521e-09 ] [ -4.173612418825651e-10 -5.831666551452671e-10 4.326416489245886e-09 ] [ 5.989343161412083e-10 4.609385233563801e-10 -6.128287122321102e-10 ] [ -1.551894710821123e-09 7.675052464690733e-10 2.861891673910228e-09 ] [ 4.273661940088128e-10 -1.146230800229357e-09 -1.727297001824755e-09 ] [ -7.192925475959596e-10 -3.582133190718687e-09 1.620325596907436e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.935039 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.315468976613621e-18 } }