{ "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" [ 5.46879 0 0 ] "si-unit" "m" "si-value" [ 5.468790000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.164352 5.45396 0 ] "si-unit" "m" "si-value" [ -1.64352e-11 5.453960000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.164037 0.0480481 5.25114 ] "si-unit" "m" "si-value" [ -1.64037e-11 4.804810000000001e-12 5.251140000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.110213 -0.12035 -0.0596546 ] [ 1.31419 1.39201 1.41434 ] [ -0.168287 2.6382 2.797 ] [ 1.3034 4.08885 4.02601 ] [ 2.55869 -0.0573607 2.7167 ] [ 3.95328 1.36182 4.12861 ] [ 2.72846 2.73806 0.151815 ] [ 4.07331 4.0714 1.3741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.10213e-11 -1.2035e-11 -5.96546e-12 ] [ 1.31419e-10 1.39201e-10 1.41434e-10 ] [ -1.68287e-11 2.6382e-10 2.797e-10 ] [ 1.3034e-10 4.08885e-10 4.02601e-10 ] [ 2.55869e-10 -5.736070000000001e-12 2.7167e-10 ] [ 3.95328e-10 1.36182e-10 4.12861e-10 ] [ 2.72846e-10 2.73806e-10 1.51815e-11 ] [ 4.07331e-10 4.0714e-10 1.3741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.539019500000001 0.35735040000000007 1.5284373000000004 ] [ -1.8076011000000005 -1.1487445000000003 -0.7138503000000002 ] [ 1.5185818000000004 1.0557461000000001 -0.8367916000000002 ] [ -3.837308900000001 -1.1538156000000002 1.2055825000000002 ] [ 3.880910500000001 1.4796755000000001 -1.6326459000000004 ] [ -2.5261562000000004 0.42250890000000013 -1.7842905000000004 ] [ 0.25942940000000003 -1.1229348000000001 -0.3500227000000001 ] [ -2.0268751000000003 0.11021400000000002 2.5835812000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.272310924255307e-09 5.725384563135285e-10 2.448826508418676e-09 ] [ -2.896096222152364e-09 -1.840491581172586e-09 -1.143714261411066e-09 ] [ 2.433036256732382e-09 1.691491718920779e-09 -1.340687938001826e-09 ] [ -6.148046606367767e-09 -1.848616379034325e-09 1.931556095945616e-09 ] [ 6.217904070517241e-09 2.370701492470551e-09 -2.615787091024975e-09 ] [ -4.04734840412897e-09 6.769338816599254e-10 -2.858748523815543e-09 ] [ 4.156517194281716e-10 -1.799139883242724e-09 -5.607981866892923e-10 ] [ -3.247411898501662e-09 1.765822940848512e-10 4.13935339657841e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.452306 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.680085582664757e-18 } }