{ "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" [ [ 1.4641529000000002 1.5671183000000004 0.18288010000000002 ] [ -0.7958698000000002 -0.5912653000000001 0.33093510000000004 ] [ 0.006150100000000002 0.5118672000000001 -1.0044878000000002 ] [ 0.3138577000000001 -0.5046373000000001 -0.5168828000000001 ] [ 0.11965370000000003 0.5056364000000001 -0.35465230000000003 ] [ 0.21568970000000007 0.0006173000000000001 -0.7655389000000002 ] [ -0.29637670000000005 0.6056411000000002 0.30511030000000006 ] [ -1.0272577000000003 -2.0949778000000006 1.8226363000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.345831564983339e-09 2.510800322973803e-09 2.930062230435834e-10 ] [ -1.275123997266253e-09 -9.473114481550003e-10 5.302164845904534e-10 ] [ 9.853546516763402e-12 8.201016675510048e-10 -1.609366882298065e-09 ] [ 5.028554733409819e-10 -8.085180907048482e-10 -8.281375446764953e-10 ] [ 1.917063623116458e-10 8.101188253798777e-10 -5.682156282543582e-10 ] [ 3.455729975344698e-10 9.890236361682e-13 -1.226528537998063e-09 ] [ -4.748478236020279e-10 9.703440190100576e-10 4.888405934527302e-10 ] [ -1.645848284036582e-09 -3.356524479908726e-09 2.920185292140215e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.344845292303475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.662868525967352e-18 } }