{ "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" [ [ 11.023957100000002 13.938766800000003 -10.123936900000002 ] [ 1.5881885000000004 1.1097258000000003 -0.5866089000000001 ] [ 13.110540100000003 10.064483400000002 -9.869411500000002 ] [ -4.2387139000000005 2.7236336000000003 -8.946830000000002 ] [ -9.067245700000003 5.9405467000000005 11.884314200000002 ] [ -5.899633000000001 -15.911903000000004 4.3945113000000005 ] [ -0.5451028000000001 -2.8793537000000002 10.077625100000002 ] [ -5.971990400000001 -14.985899500000004 3.1703368000000007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.766232633432217e-08 2.233236628974323e-08 -1.622033501163443e-08 ] [ 2.544558484123421e-09 1.777976732258577e-09 -9.398510651332053e-10 ] [ 2.10054008342809e-08 1.61250800039097e-08 -1.581254036635466e-08 ] [ -6.79116831283999e-09 4.363742077545339e-09 -1.433440185627207e-08 ] [ -1.452732907558933e-08 9.517805037510593e-09 1.904077036548146e-08 ] [ -9.452254063900168e-09 -2.549367897903739e-08 7.040783264701416e-09 ] [ -8.733509620926185e-10 -4.613233181153977e-09 1.614613532840727e-08 ] [ -9.568183398522042e-09 -2.401005782055842e-08 5.079439501021886e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.190607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.914456525356083e-18 } }