{ "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" [ [ 1.8333208000000005 2.0164725000000003 -0.10544960000000003 ] [ -0.7952279000000002 -0.6112913000000001 0.34883700000000006 ] [ -0.0042374000000000005 0.4809669000000001 -0.9665936000000003 ] [ 0.43284050000000013 -0.6579857000000001 -0.5886420000000001 ] [ 0.08118750000000001 0.4894647000000001 -0.33303070000000007 ] [ 0.14356850000000002 -0.07796340000000002 -0.9299760000000002 ] [ -0.30869460000000004 0.7981000000000003 0.37235730000000006 ] [ -1.3827573000000002 -2.4377638000000004 2.2024975000000007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.937303724186354e-09 3.230745095986129e-09 -1.689488837927117e-10 ] [ -1.274095549587881e-09 -9.793966293584392e-10 5.588984858700097e-10 ] [ -6.789063212977921e-12 7.705939225586517e-10 -1.548653667734907e-09 ] [ 6.934869296353826e-10 -1.054209305360723e-09 -9.431084504209536e-10 ] [ 1.300767144012e-10 7.84208899046886e-10 -5.335740015486587e-10 ] [ 2.300220941833248e-10 -1.249111367580787e-10 -1.489985805105101e-09 ] [ -4.945832710872078e-10 1.27869716106048e-09 5.96582160644212e-10 ] [ -2.215421418300532e-09 -3.905728167392568e-09 3.528790001870449e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.282317 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.813068004585439e-18 } }