Switch to using HalfIntegers (#6)

* swich to using HalfIntegers, add project.toml, bump version, update CI

* add Random and add seed to avoid unlikely test failure
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Jutho 2019-07-09 00:53:40 +02:00 committed by GitHub
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8 changed files with 50 additions and 417 deletions

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@ -4,9 +4,9 @@ os:
- linux
- osx
julia:
- 0.7
- 1.0
- 1.1
- 1.2
- nightly
notifications:
email: false

19
Project.toml Normal file
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@ -0,0 +1,19 @@
name = "WignerSymbols"
uuid = "9f57e263-0b3d-5e2e-b1be-24f2bb48858b"
authors = ["Jutho Haegeman"]
version = "1.0.0"
[deps]
HalfIntegers = "f0d1745a-41c9-11e9-1dd9-e5d34d218721"
Primes = "27ebfcd6-29c5-5fa9-bf4b-fb8fc14df3ae"
[compat]
julia = "1"
[extras]
Test = "8dfed614-e22c-5e08-85e1-65c5234f0b40"
LinearAlgebra = "37e2e46d-f89d-539d-b4ee-838fcccc9c8e"
Random = "9a3f8284-a2c9-5f02-9a11-845980a1fd5c"
[targets]
test = ["Test", "LinearAlgebra", "Random"]

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@ -1,2 +0,0 @@
julia 0.7
Primes

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@ -1,7 +1,8 @@
environment:
matrix:
- julia_version: 0.7
- julia_version: 1
- julia_version: 1.1
- julia_version: 1.2
- julia_version: nightly
platform:

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@ -3,8 +3,8 @@ module WignerSymbols
export δ, Δ, clebschgordan, wigner3j, wigner6j, racahV, racahW, HalfInteger
using Base.GMP.MPZ
using HalfIntegers
include("halfinteger.jl")
include("primefactorization.jl")
const Wigner3j = Dict{Tuple{UInt,UInt,UInt,Int,Int},Tuple{Rational{BigInt},Rational{BigInt}}}()
@ -29,13 +29,7 @@ end
Checks the triangle conditions `j₃ <= j₁ + j₂`, `j₁ <= j₂ + j₃` and `j₂ <= j₃ + j₁`.
"""
function δ(j₁, j₂, j₃)
j₃ <= j₁ + j₂ || return false
j₁ <= j₂ + j₃ || return false
j₂ <= j₃ + j₁ || return false
isinteger(j₁+j₂+j₃) || return false
return true
end
δ(j₁, j₂, j₃) = (j₃ <= j₁ + j₂) && (j₁ <= j₂ + j₃) && (j₂ <= j₃ + j₁) && isinteger(j₁+j₂+j₃)
# triangle coefficient
"""
@ -51,7 +45,7 @@ throws a `DomainError` if the `jᵢ`s are not (half)integer
Δ(j₁, j₂, j₃) = Δ(Float64, j₁, j₂, j₃)
function Δ(T::Type{<:AbstractFloat}, j₁, j₂, j₃)
for jᵢ in (j₁, j₂, j₃)
(ishalfinteger(jᵢ) && jᵢ >= 0) || throw(DomainError("invalid jᵢ", jᵢ))
(ishalfinteger(jᵢ) && jᵢ >= zero(jᵢ)) || throw(DomainError("invalid jᵢ", jᵢ))
end
if !δ(j₁, j₂, j₃)
return zero(T)
@ -109,7 +103,8 @@ function wigner3j(T::Type{<:AbstractFloat}, j₁, j₂, j₃, m₁, m₂, m₃ =
Wigner3j[(β₁, β₂, β₃, α₁, α₂)] = (r,s)
end
return sgn*sqrt(convert(T, r.num)/convert(T, r.den))*(convert(T, s.num)/convert(T, s.den))
sn, sd, rn, rd = convert.(T, (s.num, s.den, r.num, r.den))
return sgn*(sn/sd)*sqrt(rn/rd)
end
"""
@ -121,7 +116,8 @@ as a type `T` floating point number. By default, `T = Float64` and `m₃ = m₁+
Returns `zero(T)` if the triangle condition `δ(j₁, j₂, j₃)` is not satisfied, but
throws a `DomainError` if the `jᵢ`s and `mᵢ`s are not (half)integer or `abs(mᵢ) > jᵢ`.
"""
clebschgordan(j₁, m₁, j₂, m₂, j₃, m₃ = m₁+m₂) = clebschgordan(Float64, j₁, m₁, j₂, m₂, j₃, m₃)
clebschgordan(j₁, m₁, j₂, m₂, j₃, m₃ = m₁+m₂) =
clebschgordan(Float64, j₁, m₁, j₂, m₂, j₃, m₃)
function clebschgordan(T::Type{<:AbstractFloat}, j₁, m₁, j₂, m₂, j₃, m₃ = m₁+m₂)
s = wigner3j(T, j₁, j₂, j₃, m₁, m₂, -m₃)
iszero(s) && return s
@ -162,13 +158,13 @@ wigner6j(j₁, j₂, j₃, j₄, j₅, j₆) = wigner6j(Float64, j₁, j₂, j
function wigner6j(T::Type{<:AbstractFloat}, j₁, j₂, j₃, j₄, j₅, j₆)
# check validity of `jᵢ`s
for jᵢ in (j₁, j₂, j₃, j₄, j₅, j₆)
(ishalfinteger(jᵢ) && jᵢ >= 0) || throw(DomainError("invalid jᵢ", jᵢ))
(ishalfinteger(jᵢ) && jᵢ >= zero(jᵢ)) || throw(DomainError("invalid jᵢ", jᵢ))
end
α̂₁ = map(converthalfinteger, (j₁, j₂, j₃))
α̂₂ = map(converthalfinteger, (j₁, j₆, j₅))
α̂₃ = map(converthalfinteger, (j₂, j₄, j₆))
α̂₄ = map(converthalfinteger, (j₃, j₄, j₅))
α̂₁ = (j₁, j₂, j₃)
α̂₂ = (j₁, j₆, j₅)
α̂₃ = (j₂, j₄, j₆)
α̂₄ = (j₃, j₄, j₅)
# check triangle conditions
if !(δ(α̂₁...) && δ(α̂₂...) && δ(α̂₃...) && δ(α̂₄...))
@ -206,7 +202,8 @@ function wigner6j(T::Type{<:AbstractFloat}, j₁, j₂, j₃, j₄, j₅, j₆)
Wigner6j[(β₁, β₂, β₃, α₁, α₂, α₃)] = (r, s)
end
return sqrt(convert(T, r.num)/convert(T, r.den))*(convert(T, s.num)/convert(T, s.den))
sn, sd, rn, rd = convert.(T, (s.num, s.den, r.num, r.den))
return (sn/sd)*sqrt(rn/rd)
end
"""

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@ -1,190 +0,0 @@
# HalfInteger
"""
struct HalfInteger <: Real
Represents half-integer values.
---
HalfInteger(numerator::Integer, denominator::Integer)
Constructs a `HalfInteger` object as a rational number from the given integer numerator
and denominator values.
# Examples
```jldoctest
julia> HalfInteger(1, 2)
1/2
julia> HalfInteger(-2, 1)
-2
```
"""
struct HalfInteger <: Real
numerator::Int # with an implicit denominator of 2
function HalfInteger(num::Integer, den::Integer)
(den == 2) && return new(num)
(den == 1) && return new(2*num)
(den == 0) && throw(ArgumentError("Denominator can not be zero."))
# If non-trivial, we'll see if we can reduce it down to a half-integer
numerator, r = divrem(2*num, den)
if r == 0
return new(numerator)
else
throw(ArgumentError("$num // $den is not a half-integer value."))
end
end
end
"""
HalfInteger(x::Real)
Attempts to create a `HalfInteger` out of the real number `x`. Throws an `InexactError` if
`x` can not be represented as a half-integer value.
# Examples
```jldoctest
julia> HalfInteger(3)
3
julia> HalfInteger(1.5)
3/2
```
"""
HalfInteger(x::Real) = convert(HalfInteger, x)
Base.promote_rule(::Type{HalfInteger}, ::Type{<:Integer}) = HalfInteger
Base.promote_rule(::Type{HalfInteger}, T::Type{<:Rational}) = T
Base.promote_rule(::Type{HalfInteger}, T::Type{<:Real}) = T
Base.convert(::Type{HalfInteger}, n::Integer) = HalfInteger(2*n, 2)
function Base.convert(::Type{HalfInteger}, r::Rational)
if r.den == 1
return HalfInteger(2*r.num, 2)
elseif r.den == 2
return HalfInteger(r.num, 2)
else
throw(InexactError(:HalfInteger, HalfInteger, r))
end
end
function Base.convert(::Type{HalfInteger}, r::Real)
num = 2*r
if isinteger(num)
return HalfInteger(convert(Int, num), 2)
else
throw(InexactError(:HalfInteger, HalfInteger, r))
end
end
Base.convert(T::Type{<:Integer}, s::HalfInteger) = iseven(s.numerator) ? convert(T, s.numerator>>1) : throw(InexactError(Symbol(T), T, s))
Base.convert(T::Type{<:Rational}, s::HalfInteger) = convert(T, s.numerator//2)
Base.convert(T::Type{<:AbstractFloat}, s::HalfInteger) = convert(T, s.numerator) / T(2)
Base.convert(::Type{HalfInteger}, s::HalfInteger) = s
# Arithmetic
Base.:+(a::HalfInteger, b::HalfInteger) = HalfInteger(a.numerator+b.numerator, 2)
Base.:-(a::HalfInteger, b::HalfInteger) = HalfInteger(a.numerator-b.numerator, 2)
Base.:-(a::HalfInteger) = HalfInteger(-a.numerator, 2)
Base.:*(a::Integer, b::HalfInteger) = HalfInteger(a * b.numerator, 2)
Base.:*(a::HalfInteger, b::Integer) = b * a
Base.:<=(a::HalfInteger, b::HalfInteger) = a.numerator <= b.numerator
Base.:<(a::HalfInteger, b::HalfInteger) = a.numerator < b.numerator
Base.one(::Type{HalfInteger}) = HalfInteger(2, 2)
Base.zero(::Type{HalfInteger}) = HalfInteger(0, 2)
Base.floor(x::HalfInteger) = isinteger(x) ? x : x - HalfInteger(1, 2)
Base.floor(::Type{T}, x::HalfInteger) where T <: Integer = convert(T, floor(x))
Base.ceil(x::HalfInteger) = isinteger(x) ? x : x + HalfInteger(1, 2)
Base.ceil(::Type{T}, x::HalfInteger) where T <: Integer = convert(T, ceil(x))
# Hashing
function Base.hash(a::HalfInteger, h::UInt)
iseven(a.numerator) && return hash(a.numerator>>1, h)
num, den = a.numerator, 2
den = 1
pow = -1
if abs(num) < 9007199254740992
return hash(ldexp(Float64(num),pow), h)
end
h = Base.hash_integer(den, h)
h = Base.hash_integer(pow, h)
h = Base.hash_integer(num, h)
return h
end
# Parsing and printing
"""
parse(HalfInteger, s)
Parses the string `s` into the corresponding `HalfInteger`-value. String can either be a
number or a fraction of the form `n/2`.
"""
function Base.parse(::Type{HalfInteger}, s::AbstractString)
if in('/', s)
num, den = split(s, '/'; limit=2)
parse(Int, den) == 2 ||
throw(ArgumentError("Denominator not 2 in HalfInteger string '$s'."))
HalfInteger(parse(Int, num), 2)
elseif !isempty(strip(s))
HalfInteger(parse(Int, s))
else
throw(ArgumentError("input string is empty or only contains whitespace"))
end
end
Base.show(io::IO, x::HalfInteger) =
print(io, iseven(x.numerator) ? "$(div(x.numerator, 2))" : "$(x.numerator)/2")
# Other methods
Base.isinteger(a::HalfInteger) = iseven(a.numerator)
ishalfinteger(a::HalfInteger) = true
ishalfinteger(a::Integer) = true
ishalfinteger(a::Rational) = a.den == 1 || a.den == 2
ishalfinteger(a::Real) = isinteger(2*a)
converthalfinteger(a::Number) = convert(HalfInteger, a)
Base.numerator(a::HalfInteger) = iseven(a.numerator) ? div(a.numerator, 2) : a.numerator
Base.denominator(a::HalfInteger) = iseven(a.numerator) ? 1 : 2
# Range of HalfIntegers
"""
struct HalfIntegerRange <: AbstractVector{HalfInteger}
A range of `HalfInteger` values from `start` to `stop`, spaced by `1`. The `a:b` syntax
where both `a` and `b` are `HalfInteger`s can also be use to construct this range.
"""
struct HalfIntegerRange <: AbstractVector{HalfInteger}
start :: HalfInteger
stop :: HalfInteger
function HalfIntegerRange(start::HalfInteger, stop::HalfInteger)
(start <= stop) ||
throw(ArgumentError("Second argument must be greater or equal to the first."))
return new(start, stop)
end
end
Base.iterate(it::HalfIntegerRange) = (it.start, it.start + 1)
Base.iterate(it::HalfIntegerRange, s) = (s <= it.stop) ? (s, s+1) : nothing
Base.length(it::HalfIntegerRange) = floor(Int, it.stop - it.start) + 1
Base.size(it::HalfIntegerRange) = (length(it),)
function Base.getindex(it::HalfIntegerRange, i::Integer)
1 <= i <= length(it) || throw(BoundsError(it, i))
it.start + i - 1
end
"""
(:)(i::HalfInteger, j::HalfInteger)
Constructs a `HalfIntegerRange` out of two `HalfInteger` values.
"""
Base.:(:)(i::HalfInteger, j::HalfInteger) = HalfIntegerRange(i, j)

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@ -1,194 +0,0 @@
using Test
using WignerSymbols: HalfInteger, ishalfinteger, HalfIntegerRange
@testset "HalfInteger" begin
@testset "HalfInteger type" begin
# HalfInteger constructors
@test HalfInteger(1, 2).numerator == 1
@test HalfInteger(1, 1).numerator == 2
@test HalfInteger(0, 1).numerator == 0
@test HalfInteger(0, 2).numerator == 0
@test HalfInteger(0, 5).numerator == 0
@test HalfInteger(10, 5).numerator == 4
@test HalfInteger(21, 14).numerator == 3
@test HalfInteger(-3, 2).numerator == -3
@test HalfInteger(3, -2).numerator == -3
@test HalfInteger(-3, -2).numerator == 3
@test_throws ArgumentError HalfInteger(1, 0)
@test_throws ArgumentError HalfInteger(1, 3)
@test_throws ArgumentError HalfInteger(1, -3)
@test_throws ArgumentError HalfInteger(-5, 3)
@test_throws ArgumentError HalfInteger(-1000, -999)
# convert methods
@test convert(HalfInteger, 2) === HalfInteger(2, 1)
@test convert(HalfInteger, 1//2) === HalfInteger(1, 2)
@test convert(HalfInteger, 1.5) === HalfInteger(3, 2)
@test_throws InexactError convert(HalfInteger, 1//3)
@test_throws InexactError convert(HalfInteger, 0.6)
@test convert(HalfInteger, 2) === HalfInteger(2, 1)
@test convert(HalfInteger, 1//2) === HalfInteger(1, 2)
@test convert(HalfInteger, 1.5) === HalfInteger(3, 2)
@test convert(Integer, HalfInteger(2, 1)) === 2
@test_throws InexactError convert(Integer, HalfInteger(1, 2))
@test convert(Float64, HalfInteger(3, 2)) isa Float64
@test convert(Float32, HalfInteger(3, 2)) isa Float32
@test convert(Float64, HalfInteger(3, 2)) == 1.5
@test convert(Real, HalfInteger(3, 2)) === HalfInteger(3, 2)
# single-argument constructor
@test HalfInteger(0) == HalfInteger(0, 2)
@test HalfInteger(1) == HalfInteger(1, 1)
@test HalfInteger(2) == HalfInteger(2, 1)
@test HalfInteger(-30) == HalfInteger(-60, 2)
@test HalfInteger(0//2) == HalfInteger(0, 1)
@test HalfInteger(1//2) == HalfInteger(1, 2)
@test HalfInteger(-5//2) == HalfInteger(-5, 2)
end
a = HalfInteger(2)
b = HalfInteger(3, 2)
@testset "HalfInteger arithmetic" begin
@test a + b == 2 + 3//2
@test a - b == 2 - 3//2
@test zero(a) == 0
@test one(a) == 1
@test a > b
@test b < a
@test b <= a
@test a >= b
@test a == a
@test a != b
@test 2 * HalfInteger(0) == HalfInteger(0)
@test 2 * HalfInteger(1, 2) == HalfInteger(1)
@test HalfInteger(1) * 2 == HalfInteger(2)
@test 2 * a == HalfInteger(4)
@test (-1) * b == HalfInteger(-3//2)
@test floor(HalfInteger(0)) === HalfInteger(0)
@test floor(HalfInteger(-1)) === HalfInteger(-1)
@test floor(HalfInteger(1, 2)) === HalfInteger(0)
@test floor(HalfInteger(-1, 2)) === HalfInteger(-1)
@test floor(Int, HalfInteger(0)) === 0
@test floor(Int, HalfInteger(1, 2)) === 0
@test floor(Int32, HalfInteger(-5, 2)) === Int32(-3)
@test floor(Int32, HalfInteger(5)) === Int32(5)
@test ceil(HalfInteger(0)) === HalfInteger(0)
@test ceil(HalfInteger(-1)) === HalfInteger(-1)
@test ceil(HalfInteger(1, 2)) === HalfInteger(1)
@test ceil(HalfInteger(-1, 2)) === HalfInteger(0)
@test ceil(Int, HalfInteger(0)) === 0
@test ceil(Int, HalfInteger(1, 2)) === 1
@test ceil(Int32, HalfInteger(-5, 2)) === Int32(-2)
@test ceil(Int32, HalfInteger(5)) === Int32(5)
for n in -98:7:98
halfint, rat = HalfInteger(n, 2), n // 2
@test halfint == rat
@test halfint == HalfInteger(n / 2)
iseven(n) && @test halfint == HalfInteger(div(n, 2))
@test ceil(halfint) == ceil(rat)
@test floor(halfint) == floor(rat)
end
end
@testset "Parsing and printing" begin
@test string(HalfInteger(0)) == "0"
@test string(HalfInteger(1)) == "1"
@test string(HalfInteger(-1)) == "-1"
@test string(HalfInteger(1, 2)) == "1/2"
@test string(HalfInteger(-3, 2)) == "-3/2"
@test parse(HalfInteger, "0") == HalfInteger(0)
@test parse(HalfInteger, "1") == HalfInteger(1)
@test parse(HalfInteger, "210938") == HalfInteger(210938)
@test parse(HalfInteger, "-15") == HalfInteger(-15)
@test parse(HalfInteger, "1/2") == HalfInteger(1//2)
@test parse(HalfInteger, "-3/2") == HalfInteger(-3//2)
@test_throws ArgumentError parse(HalfInteger, "")
@test_throws ArgumentError parse(HalfInteger, "-50/100")
@test_throws ArgumentError parse(HalfInteger, "1/3")
end
@testset "HalfInteger hashing" begin
@test hash(a) == hash(2)
@test hash(b) == hash(1.5)
end
@testset "Other HalfInteger methods" begin
@test isinteger(HalfInteger(0))
@test isinteger(HalfInteger(1))
@test !isinteger(HalfInteger(1, 2))
@test ishalfinteger(1)
@test ishalfinteger(1.0)
@test ishalfinteger(-0.5)
@test ishalfinteger(HalfInteger(0))
@test ishalfinteger(HalfInteger(1, 2))
@test ishalfinteger(1//1)
@test ishalfinteger(1//2)
@test !ishalfinteger(0.3)
@test !ishalfinteger(-5//7)
@test numerator(HalfInteger(0)) == 0
@test numerator(HalfInteger(1, 2)) == 1
@test numerator(HalfInteger(1)) == 1
@test numerator(HalfInteger(-3, 2)) == -3
@test denominator(HalfInteger(0)) == 1
@test denominator(HalfInteger(1, 2)) == 2
@test denominator(HalfInteger(1)) == 1
@test denominator(HalfInteger(-3, 2)) == 2
end
@testset "HalfIntegerRange" begin
hi(x) = HalfInteger(x)
@test length(HalfIntegerRange(hi(0), hi(0))) == 1
@test length(HalfIntegerRange(hi(0), hi(2))) == 3
let hirange = HalfIntegerRange(hi(-1//2), hi(1//2))
@test length(hirange) == 2
@test size(hirange) == (2,)
@test collect(hirange) == [hi(-1//2), hi(1//2)]
end
let hirange = HalfIntegerRange(hi(0), hi(1//2))
@test length(hirange) == 1
@test size(hirange) == (1,)
@test collect(hirange) == [hi(0)]
end
let hirange = HalfIntegerRange(hi(1//2), hi(3))
@test length(hirange) == 3
@test size(hirange) == (3,)
@test collect(hirange) == [hi(1//2), hi(3//2), hi(5//2)]
end
@test hi(5):hi(7) == HalfIntegerRange(hi(5), hi(7))
@test hi(-1//2):hi(1//2) == HalfIntegerRange(hi(-1//2), hi(1//2))
@test collect(hi(0) : hi(2)) == [hi(0), hi(1), hi(2)]
@test collect(hi(-3//2) : hi(1//2)) == [hi(-3//2), hi(-1//2), hi(1//2)]
let hirange = hi(-3//2):hi(0)
@test length(hirange) == 2
@test size(hirange) == (2,)
@test collect(hirange) == [hi(-3//2), hi(-1//2)]
end
@test hi(1//2) hi(-1//2) : hi(1//2)
@test 1 hi(0) : hi(2)
@test 1//2 hi(-1//2) : hi(7//2)
@test !(hi(1//2) hi(0) : hi(1))
@test !(1//2 hi(-1) : hi(7))
r = hi(-3//2) : hi(3//2)
@test r[1] == hi(-3//2)
@test r[2] == hi(-1//2)
@test r[3] == hi(1//2)
@test r[4] == hi(3//2)
@test_throws BoundsError r[0]
@test_throws BoundsError r[5]
end
end

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@ -1,8 +1,9 @@
using Test
using WignerSymbols
using LinearAlgebra
using Random
include("halfinteger.jl")
Random.seed!(1234)
smalljlist = 0:1//2:10
largejlist = 0:1//2:1000
@ -99,8 +100,9 @@ end
Y = (2*j+1)*( j*(j+1)*( -j*(j+1) + j2*(j2+1) + j3*(j3+1) - 2*l1*(l1+1)) +
l2*(l2+1)*( j*(j+1) + j2*(j2+1) - j3*(j3+1) ) +
l3*(l3+1)*( j*(j+1) - j2*(j2+1) + j3*(j3+1) ) )
Z = (j+1)*sqrt((j^2-(j2-j3)^2)*((j2+j3+1)^2-j^2)*(j^2-(l2-l3)^2)*((l2+l3+1)^2 - j^2))
tol = 10*max(abs(X),abs(Y),abs(Z))*eps(BigFloat)
Z = (j+1) * sqrt( (j^2-(j2-j3)^2) * ((j2+j3+1)^2-j^2) *
(j^2-(l2-l3)^2) * ((l2+l3+1)^2-j^2) )
tol = 10 * max(abs(X), abs(Y), abs(Z)) * eps(BigFloat)
@test (X*wigner6j(BigFloat,j+1,j2,j3,l1,l2,l3) + Z*wigner6j(BigFloat,j-1,j2,j3,l1,l2,l3))(-Y*wigner6j(BigFloat,j,j2,j3,l1,l2,l3)) atol=tol
end
end
@ -121,15 +123,15 @@ end
M = rand(-J:J) # only test for one instance of M in -J:J, should be independent of M anyway
fill!(V1,0)
fill!(V2,0)
for (k1,m1) in enumerate(m1range)
for (k2,m2) in enumerate(m2range)
abs(m1+m2)<=J12 || continue
for (k3,m3) in enumerate(m3range)
abs(m2+m3)<=J23 || continue
m1+m2+m3==M || continue
V1[k1,k2,k3] = clebschgordan(j1,m1,j2,m2,J12)*clebschgordan(J12,m1+m2,j3,m3,J)
V2[k1,k2,k3] = clebschgordan(j2,m2,j3,m3,J23)*clebschgordan(j1,m1,J23,m2+m3,J)
end
for (k1,m1) in enumerate(m1range), (k2,m2) in enumerate(m2range)
abs(m1+m2)<=J12 || continue
for (k3,m3) in enumerate(m3range)
abs(m2+m3)<=J23 || continue
m1+m2+m3==M || continue
V1[k1,k2,k3] = clebschgordan(j1,m1,j2,m2,J12) *
clebschgordan(J12,m1+m2,j3,m3,J)
V2[k1,k2,k3] = clebschgordan(j2,m2,j3,m3,J23) *
clebschgordan(j1,m1,J23,m2+m3,J)
end
end
@test racahW(j1,j2,J,j3,J12,J23) dot(V2,V1)/sqrt((2*J12+1)*(2*J23+1)) atol=10*eps(Float64)