{ "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" [ 5.4484 0 0 ] "si-unit" "m" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00476084 5.4399 0 ] "si-unit" "m" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0697031 -0.0639637 5.39979 ] "si-unit" "m" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00902537 -0.0303023 -0.0491559 ] [ 1.28054 1.44048 1.35481 ] [ -0.0535965 2.57981 2.82719 ] [ 1.28029 4.0563 4.12138 ] [ 2.62772 -0.0777145 2.68834 ] [ 4.08246 1.48548 4.03991 ] [ 2.84369 2.84518 0.0189163 ] [ 4.03071 4.03913 1.36727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.02537e-13 -3.03023e-12 -4.91559e-12 ] [ 1.28054e-10 1.44048e-10 1.35481e-10 ] [ -5.35965e-12 2.57981e-10 2.82719e-10 ] [ 1.28029e-10 4.0563e-10 4.12138e-10 ] [ 2.62772e-10 -7.771450000000001e-12 2.68834e-10 ] [ 4.08246e-10 1.48548e-10 4.03991e-10 ] [ 2.84369e-10 2.84518e-10 1.89163e-12 ] [ 4.03071e-10 4.03913e-10 1.36727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1627766 1.7254244 1.5502914 ] [ 1.4279056 -1.5204 -0.6164636 ] [ 1.8340511 4.2450607 -3.0005389 ] [ 1.0797701 -0.9255812 -1.1901448 ] [ 0.1909569 1.7214246 0.3739426 ] [ -2.7121791 -4.7338441 1.9631109 ] [ -3.123476 -1.8753858 -0.7460004 ] [ 2.465748 1.3633013 1.6658029 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.862973483733313e-09 2.764434634637868e-09 2.483840636507301e-09 ] [ 2.287756969029397e-09 -2.43594933426432e-09 -9.87683567494203e-10 ] [ 2.938473793772523e-09 6.801337007416883e-09 -4.807393275380949e-09 ] [ 1.729982410058878e-09 -1.482944559292009e-09 -1.906822173926692e-09 ] [ 3.059466807604435e-10 2.758026248589992e-09 5.991220912411661e-10 ] [ -4.345389945442386e-09 -7.584454343532017e-09 3.145250388017647e-09 ] [ -5.004360222829901e-09 -3.004699283740305e-09 -1.195224399987448e-09 ] [ 3.950563798384358e-09 2.184249469966247e-09 2.66891046124084e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.497269 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.68728944940486e-18 } }