{ "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" [ 5.11534 0 0 ] "si-unit" "m" "si-value" [ 5.11534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.215947 5.44617 0 ] "si-unit" "m" "si-value" [ -2.15947e-11 5.446170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.311017 -0.240161 5.43903 ] "si-unit" "m" "si-value" [ 3.11017e-11 -2.40161e-11 5.43903e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.11262 0.0410701 -0.0158461 ] [ 1.41877 1.4243 1.25044 ] [ 0.19719 2.45185 3.01922 ] [ 1.59796 4.1675 4.07229 ] [ 3.2205 -0.170535 2.05026 ] [ 3.94627 1.40202 3.6633 ] [ 2.60901 3.00439 -0.668036 ] [ 3.72698 4.31381 0.563179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1262e-11 4.10701e-12 -1.58461e-12 ] [ 1.41877e-10 1.4243e-10 1.25044e-10 ] [ 1.9719e-11 2.45185e-10 3.01922e-10 ] [ 1.59796e-10 4.1675e-10 4.07229e-10 ] [ 3.2205e-10 -1.70535e-11 2.05026e-10 ] [ 3.94627e-10 1.40202e-10 3.6633e-10 ] [ 2.60901e-10 3.00439e-10 -6.68036e-11 ] [ 3.726980000000001e-10 4.31381e-10 5.63179e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.869549400000002 10.254622000000001 -8.629203000000002 ] [ 2.2476656000000004 0.5868986000000002 -0.6663191000000002 ] [ 11.059048300000002 7.047939500000002 -6.885006800000002 ] [ -1.9500823000000005 1.6906930000000004 -6.118491900000002 ] [ -10.024203000000002 4.982227400000001 10.743242600000002 ] [ -2.5337949000000006 -11.371099000000001 3.116496400000001 ] [ -5.615295700000001 -2.4991524000000003 7.2593564000000015 ] [ -1.0528874000000001 -10.692129100000002 1.1799255000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.260840806491067e-08 1.642971562354134e-08 -1.382550730273723e-08 ] [ 3.601157275696405e-09 9.403152157002512e-10 -1.067560884012498e-09 ] [ 1.771854863455799e-08 1.129204389171284e-08 -1.103099692900902e-08 ] [ -3.124376269695892e-09 2.708788797550215e-09 -9.802904676734175e-09 ] [ -1.606054368875322e-08 7.982408259789172e-09 1.721257212530261e-08 ] [ -4.059586950682275e-09 -1.821850897060226e-08 4.993177670887366e-09 ] [ -8.996695489418773e-09 -4.004083547096211e-09 1.163077110613486e-08 ] [ -1.686911576614898e-09 -1.713067927059535e-08 1.890449050385751e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.862319 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.022076651587164e-18 } }