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irrep ... main

Author SHA1 Message Date
Nuwan Yapa 7545ebf5b5 Update README.md 2026-02-18 01:09:14 +00:00
Nuwan Yapa 840efad148 First version of README.md 2026-02-14 01:02:21 +00:00
Nuwan Yapa cf9de201a9 Julia package dependencies 2026-02-13 23:53:42 +00:00
Nuwan Yapa 37acda8fac Ignore VS Code configuration files 2026-02-13 15:32:27 -05:00
Nuwan Yapa 45b43728fb R2R EC implemented 2024-07-12 18:09:36 -04:00
Nuwan Yapa 850447a507 Merge remote-tracking branch 'origin/calculations' 2024-07-12 14:52:13 -04:00
Nuwan Yapa df0b5820ea Move calculations into folder 2024-07-12 14:48:43 -04:00
Nuwan Yapa 1f4a648d52 Simple 3-body bound system 2024-04-09 18:07:17 -04:00
Nuwan Yapa 8ee4057f7e .gitignore HPC stuff 2024-02-26 10:26:48 -05:00
ysyapa d3a25b2ccf New ComplexScaling-FV calculation 2023-10-21 14:57:45 -04:00
ysyapa 922807eca1 n_imag=1 2023-09-05 16:18:19 +00:00
ysyapa 7cc20a9c27 Fixed GPU related bug 2023-08-27 23:02:51 -04:00
ysyapa 547be9fa98 Changed parameters 2023-08-25 22:09:41 +00:00
ysyapa 7a74745f7e Merge branch 'master' into calculations 2023-08-25 21:21:32 +00:00
ysyapa b21242ad49 Double krylovdim again 2023-08-25 21:20:14 +00:00
ysyapa 3d29c323d0 New calculation for paper 2023-08-25 21:03:25 +00:00
ysyapa 7fdb5947a1 Merge branch 'master' into calculations 2023-08-25 21:02:53 +00:00
Nuwan Yapa 0bcb7b3d16 Ignore calculation outputs 2023-08-14 10:46:22 -04:00
Nuwan Yapa 3f0d7566fa Merge branch 'master' into calculations 2023-08-10 05:45:10 -04:00
Nuwan Yapa 1195e63f51 Merge branch 'master' into calculations 2023-08-10 05:37:12 -04:00
ysyapa b05fb757b1 Merge branch 'master' into calculations 2023-08-10 09:11:19 +00:00
ysyapa 3b6a57c512 New parameters 2023-08-10 09:09:56 +00:00
ysyapa 490e94262b Increase N 2023-08-09 18:22:05 +00:00
ysyapa e6f32295f5 Export .dat file 2023-08-09 18:19:55 +00:00
ysyapa cbd0460600 Chose potential for new paper 2023-08-07 19:46:19 +00:00
ysyapa 911143a9ca Minor fix 2023-05-24 00:46:21 -04:00
ysyapa 8ce0f749b7 Use CPU 2023-05-23 19:13:58 +00:00
ysyapa 700d2b4308 Seperate .jl files instead of notebook 2023-05-23 19:11:36 +00:00
ysyapa d3726c725b Adopt to new interface 2023-05-23 19:08:09 +00:00
ysyapa c831c52f78 Merge branch 'master' into calculations 2023-05-23 18:43:54 +00:00
ysyapa 77eea9319c Not worrying about memory leak 2023-04-20 16:28:08 -04:00
ysyapa 7879f047f2 Merge branch 'master' into calculations 2023-04-20 16:27:33 -04:00
ysyapa 0c3fb156ae 3-body resonance calculation 2023-04-09 20:08:00 -04:00
16 changed files with 260 additions and 186 deletions

6
.gitignore vendored
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@ -1,3 +1,9 @@
# VSCode
.vscode/
# HPC scripts and logs
hpc/
# Calculation outputs
*.dat
*.csv

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@ -9,9 +9,6 @@ struct Hamiltonian{T}
K_partial::Matrix{Complex{T}}
K_diag::Union{CuTensor{Complex{T}},Nothing}
K_mixed::Union{CuTensor{Complex{T}},Nothing}
K_partial_1::Union{Tuple,Nothing}
K_partial_2::Union{Tuple,Nothing}
K_partial_c::Union{Tuple,Nothing}
Vs::Union{Array{Complex{T}},CuArray{Complex{T}}}
hermitian::Bool
mode::Hamiltonian_backend
@ -19,27 +16,25 @@ struct Hamiltonian{T}
function Hamiltonian{T}(s::system{T}, V_twobody::Function, ϕ::Real, n_image::Int, mode::Hamiltonian_backend) where {T<:Float}
@assert mode != gpu_cutensor || CUDA.functional() && CUDA.has_cuda() && CUDA.has_cuda_gpu() "CUDA not available"
k = -s.N÷2:s.N÷2-1
Vs = calculate_Vs(s, V_twobody, convert(T, ϕ), n_image)
hermitian = ϕ == 0.0
K_partial = (exp(-im * convert(T, ϕ)) * im / sqrt(2 * s.μ)) .* ∂_1DOF.(Ref(s), k, k')
K_partial_1, K_partial_2, K_partial_c = sym_reduce(s, K_partial)
Vs = calculate_Vs(s, V_twobody, convert(T, ϕ), n_image)
K_diag = nothing
K_mixed = nothing
if mode == gpu_cutensor
K_diag = CuTensor(CuArray(K_partial * K_partial), ['a', 'A'])
K_mixed = CuTensor(CuArray(K_partial), ['a', 'A']) * CuTensor(CuArray(K_partial), ['b', 'B'])
Vs = CuArray(Vs)
else
K_diag = nothing
K_mixed = nothing
end
return new{T}(s, K_partial, K_diag, K_mixed, K_partial_1, K_partial_2, K_partial_c, Vs, hermitian, mode)
return new{T}(s, K_partial, K_diag, K_mixed, Vs, hermitian, mode)
end
end
Base.size(H::Hamiltonian, i::Int)::Int = (i == 1 || i == 2) ? H.s.N^(H.s.d * (H.s.n - 2)) * length(H.s.unique_i) : throw(ArgumentError("Hamiltonian only has 2 dimesions"))
Base.size(H::Hamiltonian, i::Int)::Int = (i == 1 || i == 2) ? H.s.N^(H.s.d * (H.s.n - 1)) : throw(ArgumentError("Hamiltonian only has 2 dimesions"))
Base.size(H::Hamiltonian)::Dims{2} = (size(H, 1), size(H, 2))
"Dimensions of a vector to which 'H' can be applied"
vectorDims(H::Hamiltonian)::Dims = tuple(length(H.s.unique_i), fill(H.s.N, H.s.d * (H.s.n - 2))...)
vectorDims(H::Hamiltonian)::Dims = tuple(fill(H.s.N, H.s.d * (H.s.n - 1))...)
"Apply 'H' on 'v' and store the result in 'out' using the 'cpu_tensor' backend"
function LinearAlgebra.mul!(out::Array{Complex{T}}, H::Hamiltonian{T}, v::Array{Complex{T}})::Array{Complex{T}} where {T<:Float}
@ -47,9 +42,10 @@ function LinearAlgebra.mul!(out::Array{Complex{T}}, H::Hamiltonian{T}, v::Array{
# apply V operator
@. out = H.Vs * v
# apply K opereator
nconList_v_template = -collect(1:(H.s.d * (H.s.n - 2) + 1))
coords = H.s.n - 1
nconList_v_template = -collect(1:H.s.d*(coords))
for dim = 1:H.s.d
for coord1 = 1:(H.s.n - 1)
for coord1 = 1:coords
for coord2 = 1:coord1
i1 = which_index(H.s, dim, coord1)
i2 = which_index(H.s, dim, coord2)
@ -62,17 +58,7 @@ function LinearAlgebra.mul!(out::Array{Complex{T}}, H::Hamiltonian{T}, v::Array{
nconList_v[i1] = 1
end
nconList_v[i2] = 2
if coord1 == 1 && coord2 == 1
tensor1 = H.K_partial_1[dim]
tensor2 = H.K_partial_2[dim]
else
tensor1 = coord1 == 1 ? H.K_partial_c[dim] : H.K_partial
tensor2 = coord2 == 1 ? H.K_partial_c[dim] : H.K_partial
end
v_new = @ncon((tensor1, tensor2, v), (nconList_1, nconList_2, nconList_v))
v_new = @ncon((H.K_partial, H.K_partial, v), (nconList_1, nconList_2, nconList_v))
out = axpy!(1, v_new, out)
end
end
@ -82,8 +68,8 @@ end
"cuTENSOR contraction and accumulation (C = A * B + C)"
function contract_accumulate!(C::CuTensor, A::CuTensor, B::CuTensor)::CuTensor
CUTENSOR.contraction!(one(eltype(C)), A.data, A.inds, CUTENSOR.CUTENSOR_OP_IDENTITY, B.data, B.inds, CUTENSOR.CUTENSOR_OP_IDENTITY,
one(eltype(C)), C.data, C.inds, CUTENSOR.CUTENSOR_OP_IDENTITY, CUTENSOR.CUTENSOR_OP_IDENTITY)
cuTENSOR.contraction!(one(eltype(C)), A.data, A.inds, cuTENSOR.CUTENSOR_OP_IDENTITY, B.data, B.inds, cuTENSOR.CUTENSOR_OP_IDENTITY,
one(eltype(C)), C.data, C.inds, cuTENSOR.CUTENSOR_OP_IDENTITY, cuTENSOR.CUTENSOR_OP_IDENTITY)
return C
end
@ -148,8 +134,7 @@ function eig(H::Hamiltonian{T}, levels::Int; resonances = !H.hermitian)::Tuple{V
x₀ = CUDA.rand(Complex{T}, vectorDims(H)...)
synchronize()
end
KrylovKit_hermitian = H.hermitian && H.s.sym == all
evals, evecs, info = eigsolve(H, x₀, levels, resonances ? :LI : :SR; ishermitian = KrylovKit_hermitian, tol = tolerance, krylovdim = levels * 4)
evals, evecs, info = eigsolve(H, x₀, levels, resonances ? :LI : :SR; ishermitian = H.hermitian, tol = tolerance, krylovdim = levels * 8)
info.converged < levels && throw(error("Not enough convergence"))
if H.hermitian evals = real.(evals) end
if H.mode == gpu_cutensor # to avoid possible GPU memory leak

2
LocalPreferences.toml Normal file
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@ -0,0 +1,2 @@
[TensorOperations]
precompile_workload = true

7
Project.toml Normal file
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@ -0,0 +1,7 @@
[deps]
CUDA = "052768ef-5323-5732-b1bb-66c8b64840ba"
KrylovKit = "0b1a1467-8014-51b9-945f-bf0ae24f4b77"
NVTX = "5da4648a-3479-48b8-97b9-01cb529c0a1f"
Preferences = "21216c6a-2e73-6563-6e65-726566657250"
TensorOperations = "6aa20fa7-93e2-5fca-9bc0-fbd0db3c71a2"
cuTENSOR = "011b41b2-24ef-40a8-b3eb-fa098493e9e1"

27
README.md Normal file
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@ -0,0 +1,27 @@
# DVR-jl
Solves the quantum $n$-body problem in finite volume (lattice) with periodic boundary conditions. Uses discrete variable representation (DVR) with optional support for complex scaling to study resonances. All details can be found in [H. Yu, N. Yapa, and S. König, Complex scaling in finite volume, Phys. Rev. C 109, 014316 (2024)](https://doi.org/10.1103/PhysRevC.109.014316).
Written in Julia with optional CUDA GPU acceleration (experimental).
## Installation
Make sure you have Julia installed. Required packages can be installed with a single command:
```bash
julia --project=. -e 'import Pkg; Pkg.instantiate()'
```
## Usage
See `calculations/3b_bound.jl` for an example on a 3-body bound state.
See `calculations/3b_res_from_paper.jl` for an example of a 3-body resonance via complex scaling.
## Planned features
- [ ] Spin and isospin degrees of freedom for nuclear calculations
- [ ] Multi-node HPC support
- [ ] Parity and cubic symmetries ($S_4$)
## Acknowledgments
The author gratefully acknowledges the guidance from Sebastian König.

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calculations/3b_bound.jl Normal file
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@ -0,0 +1,19 @@
include("../Hamiltonian.jl")
mode = cpu_tensor
T = Float32
V_gauss(r2) = -2 * exp(-r2 / 4)
d = 3
n = 3
N = 20
L = 15
n_imag = 1
ϕ = 0
s = system{T}(d, n, N, L)
H = Hamiltonian{T}(s, V_gauss, ϕ, n_imag, mode)
@time evals, _, info = eig(H, 5)
print(info.numops, " operations")
display(evals)

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@ -0,0 +1,36 @@
# 10.1007/s00601-020-01550-8
# Fig. 7
# E_R = 4.18(8)
#./En.run -d 3 -n 3 -N 16 -c pot=v_shifted_gauss,v0=2.0,r=1.5,a=3.0 -c n_eig=20 -c which=li -c tol=1e-6 -L 16 -c phi=0.3 -v
include("../Hamiltonian.jl")
mode = cpu_tensor
T = Float32 # single-precision mode
using Plots
V_gauss(r2) =
2 * exp(-((sqrt(r2) - 3) / 1.5) ^ 2)
d = 3
n = 3
N = 16
L = 16
n_imag = 0
for ϕ::T in 0.2:0.05:0.4
s = system{T}(d, n, N, L)
H = Hamiltonian{T}(s, V_gauss, ϕ, n_imag, mode)
@time evals, _, info = eig(H, 20)
print(info.numops, " operations")
display(evals)
scatter(real.(evals), imag.(evals); legend=false)
xlabel!("Re E")
ylabel!("Im E")
xlims!(0, 6)
ylims!(-0.6, 0)
savefig("temp/phi$(Int(round(ϕ * 100))).png")
end

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@ -0,0 +1,24 @@
include("../Hamiltonian.jl")
mode = cpu_tensor
T = Float32 # single-precision mode
V_gauss(r2) =
-10 * exp(-(sqrt(r2)) ^ 2)
d = 3
n = 2
N = 96
ϕ = pi/6
n_imag = 1
open("ComplexScaling-FV-P-res.dat", "w") do f
for L = range(20, 35, length=16)
println("Calculating L=", L)
s = system{T}(d, n, N, L)
H = Hamiltonian{T}(s, V_gauss, ϕ, n_imag, mode)
@time evals, _, info = eig(H, 40)
dataline = vcat([L], hcat(real.(evals), imag.(evals))'[:])
println(f, join(dataline, '\t'))
end
end

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@ -0,0 +1,24 @@
include("../Hamiltonian.jl")
mode = cpu_tensor
T = Float32 # single-precision mode
V_gauss(r2) =
-10 * exp(-(sqrt(r2)) ^ 2)
d = 3
n = 2
N = 30
L = 6
n_imag = 1
open("ComplexScaling-FV-S-bound-phi.dat", "w") do f
for ϕ = range(0.0, 0.5, length=11)
println("Calculating ϕ=", ϕ)
s = system{T}(d, n, N, L)
H = Hamiltonian{T}(s, V_gauss, ϕ, n_imag, mode)
@time evals, _, info = eig(H, 10, resonances = false)
dataline = vcat([ϕ], hcat(real.(evals), imag.(evals))'[:])
println(f, join(dataline, '\t'))
end
end

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@ -0,0 +1,24 @@
include("../Hamiltonian.jl")
mode = cpu_tensor
T = Float32 # single-precision mode
V_gauss(r2) =
2 * exp(- ((sqrt(r2)-3)/1.5) ^ 2)
d = 3
n = 2
N = 96
L = 30
n_imag = 1
open("ComplexScaling-FV-S-res-phi.dat", "w") do f
for ϕ = range(0.1, 0.6, length=26)
println("Calculating ϕ=", ϕ)
s = system{T}(d, n, N, L)
H = Hamiltonian{T}(s, V_gauss, ϕ, n_imag, mode)
@time evals, _, info = eig(H, 40, resonances = true)
dataline = vcat([ϕ], hcat(real.(evals), imag.(evals))'[:])
println(f, join(dataline, '\t'))
end
end

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calculations/EC-R2R-S.jl Normal file
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@ -0,0 +1,67 @@
using Plots, Arpack
include("../helper.jl")
include("../Hamiltonian.jl")
mode = cpu_tensor
T = Float32 # single-precision mode
V_r2(c) = r2 -> c * (-5 * exp(-r2/3) + 2 * exp(-r2/10))
d = 3
n = 2
N = 48
L = 30
ϕ = pi/6
n_imag = 1
s = system{T}(d, n, N, L)
train_cs = range(0.78, 0.45, length=5)
train_ref = reverse([0.05387926313545913-0.008900278182520881im,
0.11254295298924327-0.020515067379548786im,
0.16060154707503538-0.03716539208626717im,
0.19741353362674618-0.05994519982799412im,
0.2219100763497223-0.08959449893439568im])
extrapolate_cs = range(0.38, 0.22, length=5)
extrapolate_ref = reverse([0.23165109150003316-0.12052751440975719im,
0.23190549514995962-0.1406687118589838im,
0.22763660218046278-0.1626190970863793im,
0.21807104244164865-0.18635600686249373im,
0.2020979906072586-0.21180157628258728im])
training_E = ComplexF64[]
training_vec = Array[]
exact_E = ComplexF64[]
extrapolated_E = ComplexF64[]
for c in train_cs
println("Training c=", c)
H = Hamiltonian{T}(s, V_r2(c), ϕ, n_imag, mode)
@time evals, evecs, info = eig(H, 20, resonances = true)
i = nearestIndex(evals, pop!(train_ref))
push!(training_E, evals[i])
push!(training_vec, evecs[i])
end
N_EC = [sum(x .* y) for (x, y) in Iterators.product(training_vec, training_vec)]
for c in extrapolate_cs
println("Extrapolating c=", c)
H = Hamiltonian{T}(s, V_r2(c), ϕ, n_imag, mode)
@time evals, _, info = eig(H, 40, resonances = true)
nearestE = nearest(evals, pop!(extrapolate_ref))
push!(exact_E, nearestE)
# EC extrapolation
H_training_vec = H.(training_vec)
H_EC = [sum(x .* y) for (x, y) in Iterators.product(training_vec, H_training_vec)]
evals = eigvals(H_EC, N_EC)
push!(extrapolated_E, nearestE)
end
scatter(real.(training_E), imag.(training_E), label="training")
scatter!(real.(exact_E), imag.(exact_E), label="exact")
scatter!(real.(extrapolated_E), imag.(extrapolated_E), label="extrapolated")
savefig("temp/EC-R2R-S.pdf")

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@ -1,7 +1,4 @@
include("irrep.jl")
Float = Union{Float32,Float64}
@enum rep all A1
"A few-body system defined by its physical parameters"
struct system{T}
@ -11,23 +8,7 @@ struct system{T}
L::T
μ::T
sym::rep
unique_i::Array{Int}
unique_point::Array{Int}
multiplicity::Array{Int}
labels::Array{Int}
function system{T}(d::Int, n::Int, N::Int, L::Real, μ::Real=0.5, sym::rep=all) where {T<:Float}
@assert d == 3 "Only supports 3D"
if sym == all
unique_i, unique_point, multiplicity, labels = calculate_all_data(N)
elseif sym == A1
unique_i, unique_point, multiplicity, labels = calculate_A1_data(N)
else
throw(ArgumentError("Symmetry not yet implemented"))
end
return new{T}(d, n, N, convert(T, L), convert(T, μ), sym, unique_i, unique_point, multiplicity, labels)
end
system{T}(d::Int, n::Int, N::Int, L::Real, μ::Real=0.5) where {T<:Float} = new{T}(d, n, N, convert(T, L), convert(T, μ))
end
norm_square(x::Array{Int})::Int = sum(x .* x)
@ -42,27 +23,18 @@ function ∂_1DOF(s::system{T}, k::Int, l::Int)::Complex{T} where {T<:Float}
end
"Which index (dimension of the multidimensional array) corresponds to spatial dimension 'dim' and particle 'p'?"
which_index(s::system, dim::Int, p::Int)::Int = p == 1 ? 1 : (dim - 1) * (s.n - 2) + p
"Δk (distance in terms of lattice paramter) between two particles along the given dimension"
function get_k(s::system, i::CartesianIndex, dim::Int, p::Int)::Int
if p == 1
s.unique_point[i[1], dim]
else
return i[which_index(s, dim, p)] - s.N ÷ 2 - 1
end
end
which_index(s::system, dim::Int, p::Int)::Int = (dim - 1) * (s.n - 1) + p
"Δk (distance in terms of lattice paramter) between two particles along the given dimension"
function get_Δk(s::system, i::CartesianIndex, dim::Int, p1::Int, p2::Int)::Int
if p1 == p2
return 0
elseif p1 == s.n
return -get_k(s, i, dim, p2)
return -(i[which_index(s, dim, p2)] - s.N ÷ 2 - 1)
elseif p2 == s.n
return get_k(s, i, dim, p1)
return i[which_index(s, dim, p1)] - s.N ÷ 2 - 1
else
return get_k(s, i, dim, p1) - get_k(s, i, dim, p2)
return i[which_index(s, dim, p1)] - i[which_index(s, dim, p2)]
end
end
@ -70,7 +42,7 @@ end
function calculate_Vs(s::system{T}, V_twobody::Function, ϕ::T, n_image::Int)::Array{Complex{T}} where {T<:Float}
coeff² = (exp(im * ϕ) * s.L / s.N)^2
images = collect.(Iterators.product(fill(-n_image:n_image, s.d)...)) # TODO: Learn how to use tuples instead of vectors
Vs = zeros(Complex{T}, length(s.unique_i), fill(s.N, s.d * (s.n - 2))...)
Vs = zeros(Complex{T}, fill(s.N, s.d * (s.n - 1))...)
Threads.@threads for i in CartesianIndices(Vs)
for p1 in 1:s.n
for p2 in (p1 + 1):s.n

5
helper.jl Normal file
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@ -0,0 +1,5 @@
"Index of the nearest value in a list to a given reference point"
nearestIndex(list::Array, ref) = argmin(norm.(list .- ref))
"Nearest value in a list to a given reference point"
nearest(list::Array, ref) = list[nearestIndex(list, ref)]

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@ -1,77 +0,0 @@
using DelimitedFiles, LinearAlgebra
function calculate_all_data(N::Int)
ks = -N÷2:N÷2-1
lattice = hcat((collect.(Iterators.product(ks, ks, ks)))...)
labels = reshape(collect(1:N^3), (N, N, N))
unique_i = collect(1:N^3)
multiplicity = fill(1, length(unique_i))
unique_point = transpose(lattice)
return unique_i, unique_point, multiplicity, labels
end
function calculate_A1_data(N::Int)
rotations = readdlm("rotations.mat", ',', Int, '\n')
rotations = reshape(rotations, (24, 3, 3))
ks = -N÷2:N÷2-1
lattice = hcat((collect.(Iterators.product(ks, ks, ks)))...)
labels = reshape(collect(1:N^3), (N, N, N))
for r in 1:24
rotated_lattice = Matrix(rotations[r, :, :]) * lattice
for index in 1:N^3
rotated_lattice_point = rotated_lattice[:, index]
(i, j, k) = mod1.(rotated_lattice_point .+ (N÷2 + 1), N)
old_label = max(labels[index], labels[i, j, k])
new_label = min(labels[index], labels[i, j, k])
if old_label != new_label
for o in findall(isequal(old_label), labels)
labels[o] = new_label
end
end
end
end
unique_i = unique(labels)
multiplicity = [count(labels.==i) for i in unique_i]
unique_point = transpose(lattice[:, unique_i])
return unique_i, unique_point, multiplicity, labels
end
function sym_reduce(s, K_partial)
I = one(K_partial)
K_partial_x1 = kron(kron(K_partial, I), I)
K_partial_y1 = kron(kron(I, K_partial), I)
K_partial_z1 = kron(kron(I, I), K_partial)
K_partial_x1 = K_partial_x1[s.unique_i, :]
K_partial_y1 = K_partial_y1[s.unique_i, :]
K_partial_z1 = K_partial_z1[s.unique_i, :]
K_partial_x2 = kron(kron(K_partial, I), I)
K_partial_y2 = kron(kron(I, K_partial), I)
K_partial_z2 = kron(kron(I, I), K_partial)
for (i, label) in enumerate(s.labels)
if i != label
K_partial_x2[:, label] .+= K_partial_x2[:, i]
K_partial_y2[:, label] .+= K_partial_y2[:, i]
K_partial_z2[:, label] .+= K_partial_z2[:, i]
end
end
K_partial_x2 = K_partial_x2[:, s.unique_i]
K_partial_y2 = K_partial_y2[:, s.unique_i]
K_partial_z2 = K_partial_z2[:, s.unique_i]
K_partial_xc = K_partial_x2[s.unique_i, :]
K_partial_yc = K_partial_y2[s.unique_i, :]
K_partial_zc = K_partial_z2[s.unique_i, :]
return (K_partial_x1, K_partial_y1, K_partial_z1), (K_partial_x2, K_partial_y2, K_partial_z2), (K_partial_xc, K_partial_yc, K_partial_zc)
end

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@ -1,24 +0,0 @@
1,0,0,0,1,0,0,0,1
1,0,0,0,0,-1,0,1,0
0,0,1,0,1,0,-1,0,0
0,-1,0,1,0,0,0,0,1
1,0,0,0,-1,0,0,0,-1
-1,0,0,0,1,0,0,0,-1
-1,0,0,0,-1,0,0,0,1
1,0,0,0,0,1,0,-1,0
0,0,-1,0,1,0,1,0,0
0,1,0,-1,0,0,0,0,1
0,0,-1,1,0,0,0,-1,0
0,0,1,-1,0,0,0,-1,0
0,0,-1,-1,0,0,0,1,0
0,0,1,1,0,0,0,1,0
0,1,0,0,0,-1,-1,0,0
0,-1,0,0,0,-1,1,0,0
0,-1,0,0,0,1,-1,0,0
0,1,0,0,0,1,1,0,0
0,1,0,1,0,0,0,0,-1
0,-1,0,-1,0,0,0,0,-1
0,0,1,0,-1,0,1,0,0
0,0,-1,0,-1,0,-1,0,0
-1,0,0,0,0,1,0,1,0
-1,0,0,0,0,-1,0,-1,0

View File

@ -1,23 +0,0 @@
include("Hamiltonian.jl")
println("Running with ",Threads.nthreads()," thread(s)")
T=Float32
function V_test(r2)
return -4*exp(-r2/4)
end
n = 3
N = 8
println("\n$n-body system with N=$N")
for L::T in [16]
println("L=$L")
println("Constructing Hamiltonian")
s=system{T}(3,n,N,L,0.5,A1)
@time H=Hamiltonian{T}(s,V_test,0,0,cpu_tensor)
println("Solving eigenvalues")
@time evals,_,_ = eig(H,5)
println(evals)
end