{ "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" [ 5.42631 0 0 ] "si-unit" "m" "si-value" [ 5.42631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0419811 5.40206 0 ] "si-unit" "m" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.291495 -0.184222 5.7849 ] "si-unit" "m" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4833809 -1.785977 -2.451578 ] [ 0.8321245 0.3048618 5.2556045 ] [ -1.332733 -4.2038893 -5.5573906 ] [ -0.5030781 0.2824657 8.5389469 ] [ 1.6485637 0.467106 -6.8742537 ] [ 0.7590437 0.5053918 5.616063 ] [ 0.8867344 1.2062554 -3.7636677 ] [ -0.8072743 3.2237857 -0.7637244 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.376638197721263e-09 -2.861450594686521e-09 -3.927860955667622e-09 ] [ 1.33321041949489e-09 4.884424485350054e-10 8.420406658071273e-09 ] [ -2.135273654368646e-09 -6.735373152891278e-09 -8.903921291973686e-09 ] [ -8.060199702564845e-10 4.525599407179066e-10 1.368090108943263e-08 ] [ 2.641290218039545e-09 7.483863126354049e-10 -1.10137685635879e-08 ] [ 1.216122070305529e-09 8.097269263040294e-10 8.99792483953991e-09 ] [ 1.420705124539116e-09 1.932634200593753e-09 -6.030060397400109e-09 ] [ -1.293396010032686e-09 5.165074079009363e-09 -1.223621378414507e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.403433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.948555009505921e-18 } }