BergEC-jl/calculations/3body_Berggren_B2R_EC.jl

82 lines
2.7 KiB
Julia

using Plots
training_c = [2.6, 2.4, 2.2, 2.0, 1.8]
extrapolating_c = 0.0 : 0.2 : 1.2
training_ref = -2.22 # complete list not needed because identification is simple
exact_ref = reverse([4.076662025307587-0.012709842443350328im,
3.613318119833891-0.007335804709990623im,
3.1453431847006783-0.004030580410326795im,
2.672967129943755-0.00211498327461944im,
2.196542557810288-0.0010719835443437104im,
1.7164583929199813-0.0005455212208182736im,
1.233088227541505-0.0003070320106485624im])
include("../p_space_3body_resonance.jl")
H0 = H
# Vp = perturbation to make the state artificially bound
Vp_of_r(r) = -exp(-(r/3)^2)
Vp_l(j, k, kp) = Vl_mat_elem(Vp_of_r, j, k, kp; atol=atol, maxevals=maxevals, R_cutoff=R_cutoff)
@time "Vp block diagonal part" begin
Vpb_blocks = [kron_sum(get_V_matrix((k, kp) -> Vp_l(j1, k, kp), ks, ws), spzeros(length(ks), length(ks))) for (j1, _) in js]
Vpb = blockdiag(sparse.(Vpb_blocks)...)
end
@time "Vp2_HO" Vp2_HO = get_jacobi_V2_matrix(Vp_of_r, basis_ho, μω_global; atol=atol, maxevals=maxevals)
@time "Vp2" Vp2 = W_left * Vp2_HO * transpose(W_right)
@time "Vp" Vp = Vpb + Vp2
# free memory
basis = Hb_blocks = Hb = basis_ho = V2_HO = W_right = W_left = V2 = nothing
GC.gc()
exact = ComplexF64[]
training = ComplexF64[]
extrapolated = ComplexF64[]
training_vecs = Vector{ComplexF64}[]
current_E = training_ref
for c in training_c
println("Training for c = $c")
local H = H0 + c .* Vp
local evals, evecs = eigs(H, sigma=current_E, maxiter=5000, tol=1e-5, ritzvec=true, check=1)
global current_E = nearest(evals, current_E)
push!(training, current_E)
push!(training_vecs, evecs[:, nearestIndex(evals, current_E)])
end
training_vecs = vcat(training_vecs, conj(training_vecs)) # CA-EC
EC_basis = hcat(training_vecs...)
weights_mat = spdiagm(repeat(kron(ws, ws), jmax + 1))
N_EC = transpose(EC_basis) * weights_mat * EC_basis
H0_EC = transpose(EC_basis) * weights_mat * H0 * EC_basis
Vp_EC = transpose(EC_basis) * weights_mat * Vp * EC_basis
for c in extrapolating_c
println("Extrapolating for c = $c")
global current_E = pop!(exact_ref)
local H = H0 + c .* Vp
local evals, _ = eigs(H, sigma=current_E, maxiter=5000, tol=1e-5, ritzvec=false, check=1)
global current_E = nearest(evals, current_E)
push!(exact, current_E)
# extrapolation
H_EC = H0_EC + c .* Vp_EC
evals = eigvals(H_EC, N_EC)
push!(extrapolated, nearest(evals, current_E))
end
exportCSV("temp/Berggren_B2R.csv", (training, exact, extrapolated), ("training", "exact", "extrapolated"))
scatter(real.(training),imag.(training), label="training")
scatter!(real.(exact),imag.(exact), label="exact")
scatter!(real.(extrapolated),imag.(extrapolated), label="extrapolated")
savefig("temp/Berggren_B2R.pdf")