{ "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" [ 5.3952 0 0 ] "si-unit" "m" "si-value" [ 5.3952e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00461172 5.6034 0 ] "si-unit" "m" "si-value" [ 4.61172e-13 5.6034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.071329 0.0469434 5.27588 ] "si-unit" "m" "si-value" [ 7.132900000000001e-12 4.694340000000001e-12 5.27588e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0148313 -0.0405976 0.0741579 ] [ 1.40662 1.33729 1.44565 ] [ 0.021393 2.68696 2.73819 ] [ 1.3197 4.02815 4.06112 ] [ 2.69728 0.0386556 2.72588 ] [ 4.00631 1.34667 3.9586 ] [ 2.7243 2.85873 -0.0805011 ] [ 4.14392 4.06243 1.15826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48313e-12 -4.05976e-12 7.41579e-12 ] [ 1.40662e-10 1.33729e-10 1.44565e-10 ] [ 2.1393e-12 2.68696e-10 2.73819e-10 ] [ 1.3197e-10 4.02815e-10 4.06112e-10 ] [ 2.69728e-10 3.86556e-12 2.72588e-10 ] [ 4.00631e-10 1.34667e-10 3.9586e-10 ] [ 2.7243e-10 2.85873e-10 -8.050110000000001e-12 ] [ 4.14392e-10 4.06243e-10 1.15826e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9311191000000002 0.9173434000000003 -1.1208548000000003 ] [ -0.6049826000000001 0.9046860000000002 -1.8888842000000003 ] [ -0.4143795000000001 0.5218930000000002 -1.3145894000000002 ] [ -0.3803219000000001 2.9982658000000004 -1.5295706000000004 ] [ 0.13207140000000003 -3.135812900000001 -0.6195129000000001 ] [ 1.2190283000000002 0.2665931000000001 1.3255466000000002 ] [ -0.06053450000000001 -3.055716900000001 1.7161157000000005 ] [ -0.8220003000000002 0.5827484000000002 3.431749500000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.491817253200338e-09 1.469746148725183e-09 -1.79580735587146e-09 ] [ -9.692889777107984e-10 1.449466758365069e-09 -3.026326104638512e-09 ] [ -6.639091470387938e-10 8.361647631591748e-10 -2.1062044026315e-09 ] [ -6.093428565582357e-10 4.803751367704209e-09 -2.450642255183029e-09 ] [ 2.116017093563252e-10 -5.024126115583049e-09 -9.925690846640085e-10 ] [ 1.953098642353569e-09 4.271292320865966e-10 2.12375977230093e-09 ] [ -9.698696065181762e-11 -4.895798176963453e-09 2.749520453127828e-09 ] [ -1.316989662950587e-09 9.33665862288607e-10 5.498268817342092e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.600654 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.703853552399001e-18 } }