{ "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" [ 5.52526 0 0 ] "si-unit" "m" "si-value" [ 5.52526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.163004 5.51064 0 ] "si-unit" "m" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0929221 -0.0543858 5.47616 ] "si-unit" "m" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2368689 0.2948345 -0.10676469999999998 ] [ -0.6847361 0.4360538 -1.2999304999999999 ] [ -0.877048 0.14858 -0.32419059999999994 ] [ 0.8890636 0.1590265 0.3765316999999999 ] [ -0.2007223 -1.624496 0.4127390999999999 ] [ 0.8074963 0.7756965 1.6572680999999996 ] [ -1.001286 -1.7580961 -2.3573135999999995 ] [ 2.3041013 1.5684009 1.6416604999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.981682434574613e-09 4.723769429052576e-10 -1.710559062667257e-10 ] [ -1.097068170837771e-09 6.986352037709991e-10 -2.082718255764854e-09 ] [ -1.405185800919399e-09 2.38051402318464e-10 -5.194106000031244e-10 ] [ 1.424436914324283e-09 2.547885403876512e-10 6.032702867300792e-10 ] [ -3.215925763332038e-10 -2.602729511783117e-09 6.612809365100332e-10 ] [ 1.293751693242503e-09 1.242802797136387e-09 2.655236204217636e-09 ] [ -1.604237019934349e-09 -2.816780468539659e-09 -3.776832737813882e-09 ] [ 3.691577234814887e-09 2.512855254021679e-09 2.630230072390838e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.198034240654238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.75542883840941e-18 } }