{ "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" [ 5.42386 0 0 ] "si-unit" "m" "si-value" [ 5.423860000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00583756 5.42008 0 ] "si-unit" "m" "si-value" [ -5.83756e-13 5.42008e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.133978 0.025245 5.31918 ] "si-unit" "m" "si-value" [ 1.33978e-11 2.5245e-12 5.31918e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0601366 -0.000139309 -0.0552929 ] [ 1.41186 1.40158 1.29827 ] [ 0.0312084 2.71899 2.71348 ] [ 1.40738 4.08238 4.03102 ] [ 2.73873 -0.00499376 2.66143 ] [ 4.093 1.3473 4.02214 ] [ 2.75009 2.74892 -0.00923085 ] [ 4.15824 4.1992 1.24093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.01366e-12 -1.39309e-14 -5.52929e-12 ] [ 1.41186e-10 1.40158e-10 1.29827e-10 ] [ 3.12084e-12 2.71899e-10 2.71348e-10 ] [ 1.40738e-10 4.08238e-10 4.03102e-10 ] [ 2.73873e-10 -4.993760000000001e-13 2.66143e-10 ] [ 4.093e-10 1.3473e-10 4.02214e-10 ] [ 2.75009e-10 2.74892e-10 -9.23085e-13 ] [ 4.158240000000001e-10 4.1992e-10 1.24093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1232982000000002 2.3597211000000002 -0.017511300000000004 ] [ -1.0148733000000003 -0.8017341000000002 0.33282690000000004 ] [ -0.06206730000000001 0.6143574000000002 -1.1733314000000001 ] [ 0.4262548000000001 -0.6815697000000001 -0.6472361000000001 ] [ 0.14946900000000002 0.6121095000000001 -0.3882062000000001 ] [ 0.2578383000000001 -0.15440380000000004 -1.0260240000000003 ] [ -0.3093078000000001 0.9492975000000002 0.41410190000000013 ] [ -1.5706119000000005 -2.8977779000000004 2.5053802000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.401898735026723e-09 3.78068997802846e-09 -2.805619545981504e-11 ] [ -1.626006274334145e-09 -1.28451963111813e-09 5.332474779533396e-10 ] [ -9.944277697617986e-11 9.843090630954743e-10 -1.879884137530534e-09 ] [ 6.8293547506378e-10 -1.09199503878567e-09 -1.036986547557771e-09 ] [ 2.394757373343552e-10 9.807075302695777e-10 -6.219748976896092e-10 ] [ 4.131024962068168e-10 -2.473821585226791e-10 -1.6438716651797e-09 ] [ -4.955657257910824e-10 1.520942260683888e-09 6.634643828088597e-10 ] [ -2.516397666530269e-09 -4.642752003650921e-09 4.014061582655229e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.504793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.848712589174349e-18 } }