{ "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" [ 5.44335 0 0 ] "si-unit" "m" "si-value" [ 5.44335e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0871492 5.32556 0 ] "si-unit" "m" "si-value" [ 8.71492e-12 5.32556e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0678412 -0.0738369 5.55618 ] "si-unit" "m" "si-value" [ 6.784120000000001e-12 -7.38369e-12 5.556180000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0586252 0.00658789 -0.0562217 ] [ 1.37481 1.15024 1.36711 ] [ 0.0858543 2.81471 2.72056 ] [ 1.52563 4.03682 4.13778 ] [ 2.84739 -0.239071 2.58831 ] [ 4.11503 1.39706 3.91123 ] [ 2.74645 2.72703 -0.0478687 ] [ 4.08136 4.16337 1.33715 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.86252e-12 6.58789e-13 -5.62217e-12 ] [ 1.37481e-10 1.15024e-10 1.36711e-10 ] [ 8.58543e-12 2.81471e-10 2.72056e-10 ] [ 1.52563e-10 4.03682e-10 4.13778e-10 ] [ 2.84739e-10 -2.39071e-11 2.58831e-10 ] [ 4.11503e-10 1.39706e-10 3.91123e-10 ] [ 2.74645e-10 2.72703e-10 -4.786870000000001e-12 ] [ 4.08136e-10 4.16337e-10 1.33715e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.11398849999999999 2.6681047999999996 -1.2279057999999996 ] [ 0.46818999999999994 3.1222655999999995 -0.9175591999999996 ] [ 0.0006639999999999999 -1.8236211999999998 -1.0822795999999995 ] [ -0.7057667999999999 -2.1241358999999997 -0.3013735999999999 ] [ -4.994222099999999 8.012748199999999 5.613765499999998 ] [ 0.6626060999999999 -1.4256161999999997 2.484254099999999 ] [ -0.34170849999999997 -1.1306002999999998 0.13357869999999994 ] [ 5.024225799999999 -7.299144899999999 -4.702480199999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.826297097400608e-10 4.274775132404259e-09 -1.96732196530472e-09 ] [ 7.501230720923519e-10 5.002420948248084e-09 -1.470091898439951e-09 ] [ 1.0638452762112e-12 -2.921763251835241e-09 -1.734003072288775e-09 ] [ -1.130763066696829e-09 -3.403240878381967e-09 -4.828537360463308e-10 ] [ -8.001625887702679e-09 1.283783783439728e-08 8.99424383875362e-09 ] [ 1.061612002219467e-09 -2.284088945873736e-09 3.980213839146544e-09 ] [ -5.474773698286367e-10 -1.811421368129466e-09 2.140166701768569e-10 ] [ 8.049697114380176e-09 -1.169451931061155e-08 -7.534203836214906e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.67306 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.395018948279565e-18 } }