-
Notifications
You must be signed in to change notification settings - Fork 0
/
generate-multivar-data.jl
262 lines (218 loc) · 11.4 KB
/
generate-multivar-data.jl
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
### A Pluto.jl notebook ###
# v0.19.40
using Markdown
using InteractiveUtils
# ╔═╡ 711042e8-6520-11ef-1758-491cd566c023
using Pkg, Unitful, Plots, DelimitedFiles
# ╔═╡ 07d58ada-9abe-47cf-a7fb-96b96b700b10
Pkg.activate(".")
# ╔═╡ 85d24807-1d4c-427b-9d4b-12d64f3464dc
using PolaronThesis
# ╔═╡ a6bae188-d450-45fa-a922-ea865628ba27
polaron_conductivity(frohlich) = -im ./ (frohlich.Ω .+ frohlich.Σ')
# ╔═╡ bc56571f-e612-4fc0-89fd-626f604cfd45
md"""
# Load Data
"""
# ╔═╡ 2027bdc8-95c0-4cfd-ad1c-c521f6d3e9f6
# ╠═╡ disabled = true
#=╠═╡
diagmc = readdlm("data/frohlich/diagmc/frohlich_mobility_freq_0to20_alpha_6_temp_05.txt")
╠═╡ =#
# ╔═╡ 4b6c74a7-adf4-4fdc-b3b8-0fcf724c7a97
# ╠═╡ disabled = true
#=╠═╡
frohlich_3d_alpha_0to12_beta_inf_N_2 = load_frohlich("data/frohlich/variational/multivar/frohlich_3d_alpha_0to12_beta_inf_N_2.jld")
╠═╡ =#
# ╔═╡ e64f1c29-f756-4e9e-8885-3bde4478804b
# ╠═╡ disabled = true
#=╠═╡
frohlich_3d_alpha_0to12_beta_inf_N_3 = load_frohlich("data/frohlich/variational/multivar/frohlich_3d_alpha_0to12_beta_inf_N_3.jld")
╠═╡ =#
# ╔═╡ 05ad9aee-416b-4504-afd4-83f7798dc4f9
# ╠═╡ disabled = true
#=╠═╡
frohlich_3d_alpha_0to12_beta_inf_N_4 = load_frohlich("data/frohlich/variational/multivar/frohlich_3d_alpha_0to12_beta_inf_N_4.jld")
╠═╡ =#
# ╔═╡ b81a7e50-0645-4e0a-a539-974ea1947579
# ╠═╡ disabled = true
#=╠═╡
frohlich_3d_alpha_0to12_beta_inf_N_5 = load_frohlich("data/frohlich/variational/multivar/frohlich_3d_alpha_0to12_beta_inf_N_5.jld")
╠═╡ =#
# ╔═╡ 88af9472-bc61-456c-a408-aea0524c4e0a
# ╠═╡ disabled = true
#=╠═╡
frohlich_3d_alpha_0to12_beta_inf_N_6 = load_frohlich("data/frohlich/variational/multivar/frohlich_3d_alpha_0to12_beta_inf_N_6.jld")
╠═╡ =#
# ╔═╡ c23a3621-e8ce-4852-8caf-f30cebfa6960
# ╠═╡ disabled = true
#=╠═╡
frohlich_3d_alpha_0to12_beta_003125to16_N_2 = load_frohlich("data/frohlich/variational/multivar/frohlich_3d_alpha_0to12_beta_003125to16_N_2.jld")
╠═╡ =#
# ╔═╡ 5406d718-81ab-42e1-93a7-41e0158217c6
# ╠═╡ disabled = true
#=╠═╡
frohlich_3d_alpha_0to12_beta_003125to16_N_3 = load_frohlich("data/frohlich/variational/multivar/frohlich_3d_alpha_0to12_beta_003125to16_N_3.jld")
╠═╡ =#
# ╔═╡ d4609cdc-8457-4f5d-a254-b61d949b0b84
Ωrange = LinRange(0.01, 30, 3000)
# ╔═╡ 8838e520-b35c-4fdb-9e9e-3f8519b89785
# ╠═╡ disabled = true
#=╠═╡
# 19289s
begin
frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2 = frohlich(frohlich_3d_alpha_0to12_beta_inf_N_2, Ωrange)
save_frohlich(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2, "data/frohlich/variational/multivar/frohlich-3d-alpha-0to12-beta-inf-freq-0to30-N-2")
end
╠═╡ =#
# ╔═╡ 9f176c24-b300-4738-ac3e-1eecfe752d07
# ╠═╡ disabled = true
#=╠═╡
frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2 = load_frohlich("data/frohlich/variational/multivar/frohlich-3d-alpha-0to12-beta-inf-freq-0to30-N-2.jld")
╠═╡ =#
# ╔═╡ fcd11b51-124c-4513-86ae-3fd91afae836
# ╠═╡ disabled = true
#=╠═╡
begin
data1 = Matrix{Any}(undef, length(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.Ω) + 1, length(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.α) + 1)
data1[1, 1] = "ℜΣ(ω₀)|Ω(ω₀)↓|α→"
data1[2:end, 1] = 0.01:0.01:30.0
data1[1, 2:end] = 0.1:0.1:12.0
data1[2:end, 2:end] = reverse(ustrip(real.(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.Σ)'),dims=2)
writedlm("data/frohlich/variational/multivar/frohlich-3d-real-memory-alpha-0to12-beta-100-freq-0to30-N-2.dat", data1)
data1
end
╠═╡ =#
# ╔═╡ e5067fa5-ac6e-4092-a5b5-77dc57fd0946
# ╠═╡ disabled = true
#=╠═╡
begin
data2 = Matrix{Any}(undef, length(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.Ω) + 1, length(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.α) + 1)
data2[1, 1] = "ℑΣ(ω₀)|Ω(ω₀)↓|α→"
data2[2:end, 1] = 0.01:0.01:30.0
data2[1, 2:end] = 0.1:0.1:12.0
data2[2:end, 2:end] = reverse(abs.(ustrip(imag.(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.Σ))'),dims=2)
writedlm("data/frohlich/variational/multivar/frohlich-3d-imag-memory-alpha-0to12-beta-100-freq-0to30-N-2.dat", data2)
data2
end
╠═╡ =#
# ╔═╡ c51ff0e7-8d5e-40fe-8c31-742995d1a267
# ╠═╡ disabled = true
#=╠═╡
begin
data3 = Matrix{Any}(undef, length(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.Ω) + 1, length(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.α) + 1)
data3[1, 1] = "ℜσ(e²ω₀/m₀r₀²)|Ω(ω₀)↓|α→"
data3[2:end, 1] = 0.01:0.01:30.0
data3[1, 2:end] = 0.1:0.1:12.0
data3[2:end, 2:end] = reverse(ustrip(abs.(real.(polaron_conductivity(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2)))),dims=2)
writedlm("data/frohlich/variational/multivar/frohlich-3d-real-conductivity-alpha-0to12-beta-100-freq-0to30-N-2.dat", data3)
data3
end
╠═╡ =#
# ╔═╡ a984c00a-fafa-438d-a793-0a6490e41863
# ╠═╡ disabled = true
#=╠═╡
begin
data4 = Matrix{Any}(undef, length(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.Ω) + 1, length(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2.α) + 1)
data4[1, 1] = "ℑσ(e²ω₀/m₀r₀²)|Ω(ω₀)↓|α→"
data4[2:end, 1] = 0.01:0.01:30.0
data4[1, 2:end] = 0.1:0.1:12.0
data4[2:end, 2:end] = reverse(ustrip(imag.(polaron_conductivity(frohlich_3d_alpha_0to12_beta_inf_freq_0to30_N_2))),dims=2)
writedlm("data/frohlich/variational/multivar/frohlich-3d-imag-conductivity-alpha-0to12-beta-100-freq-0to30-N-2.dat", data4)
data4
end
╠═╡ =#
# ╔═╡ 2fcf096c-5ef7-4b7f-b7d3-70e33961f9cb
αrange = [0.1, 1.0, 2.0, 3.0, 4.0, 5.0, 6.0, 7.0]
# ╔═╡ 44e69331-2672-46a1-968d-2ec1435306e6
frohlich_3d_alpha_0to12_beta_100_N_1 = frohlich(αrange, 1.0, 100.0)
# ╔═╡ 7d8b473f-0290-4724-8deb-a390d72ce74d
frohlich_3d_alpha_0to12_beta_100_N_1_0to30 = frohlich(frohlich_3d_alpha_0to12_beta_100_N_1, 0.1:0.1:10.0)
# ╔═╡ 78d660b5-eb45-41a7-b292-4432e3aaae7e
plot(0.1:0.1:10.0, real.(polaron_conductivity(frohlich_3d_alpha_0to12_beta_100_N_1_0to30)), ylims=(0,0.5))
# ╔═╡ 1554c91f-d325-4800-bc17-020491ed5c2e
frohlich_3d_alpha_0to12_beta_100_N_2 = frohlich(αrange, 1.0, 100.0; v_guesses = [6, 4], w_guesses = [5, 3], upper = 100.0)
# ╔═╡ 271f0b4e-224b-45f8-bd8b-5e8b9ae616be
frohlich_3d_alpha_0to12_beta_100_N_2_0to30 = frohlich(frohlich_3d_alpha_0to12_beta_100_N_2, 0.1:0.1:10.0)
# ╔═╡ ef3eaac1-f9d7-4e8a-bd71-11c6992985f6
plot(0.1:0.1:10.0, real.(polaron_conductivity(frohlich_3d_alpha_0to12_beta_100_N_2_0to30)), ylims=(0,0.5))
# ╔═╡ de5cf838-1f44-461e-b7c6-9c31eb7f1c40
frohlich_3d_alpha_0to12_beta_100_N_3 = frohlich(αrange, 1.0, 100.0; v_guesses = [8,6, 4], w_guesses = [7,5, 3], upper = 200.0)
# ╔═╡ 3bbac0ae-c86c-4e0a-a460-d63b22991a44
frohlich_3d_alpha_0to12_beta_100_N_3_0to30 = frohlich(frohlich_3d_alpha_0to12_beta_100_N_3, 0.1:0.1:10.0)
# ╔═╡ 14c47316-b5fd-4d6c-a7d6-6ebda865f989
plot(0.1:0.1:10.0, real.(polaron_conductivity(frohlich_3d_alpha_0to12_beta_100_N_3_0to30)), ylims=(0,0.5))
# ╔═╡ ad676377-f6be-46a3-81fd-293f0085d2c7
frohlich_3d_alpha_0to12_beta_100_N_4 = frohlich(αrange, 1.0, 100.0; v_guesses = [10,8,6,4], w_guesses = [9,7,5,3], upper = 500.0)
# ╔═╡ b10fb360-a44f-4372-bd7a-5c6a794a5be7
frohlich_3d_alpha_0to12_beta_100_N_4_0to30 = frohlich(frohlich_3d_alpha_0to12_beta_100_N_4, 0.1:0.1:10.0)
# ╔═╡ 03ac42ff-7a2c-4b61-a6d3-4500c4913080
plot(0.1:0.1:10.0, real.(polaron_conductivity(frohlich_3d_alpha_0to12_beta_100_N_4_0to30)), ylims=(0,0.5))
# ╔═╡ 8bf786ef-4d7a-4a8f-bff0-245b3e31a30e
frohlich_3d_alpha_0to12_beta_100_N_5 = frohlich(αrange, 1.0, 100.0; v_guesses = [12,10,8,6,4], w_guesses = [11,9,7,5,3], upper = 1000.0)
# ╔═╡ 88e8b2c6-0a36-4ce8-a36b-03a938209fb6
frohlich_3d_alpha_0to12_beta_100_N_5_0to30 = frohlich(frohlich_3d_alpha_0to12_beta_100_N_5, 0.1:0.1:10.0)
# ╔═╡ 404240e9-5f66-445e-a0ff-bfd6568fd23f
plot(0.1:0.1:10.0, real.(polaron_conductivity(frohlich_3d_alpha_0to12_beta_100_N_5_0to30)), ylims=(0,0.5))
# ╔═╡ 9518e064-89f1-4205-b88c-c7894c48d4b9
frohlich_3d_alpha_0to12_beta_100_N_6 = frohlich(αrange, 1.0, 100.0; v_guesses = [14,12,10,8,6,4], w_guesses = [13,11,9,7,5,3], upper = 2000.0)
# ╔═╡ 56c43383-0a6d-4bae-bdee-a3684848d169
frohlich_3d_alpha_0to12_beta_100_N_6_0to30 = frohlich(frohlich_3d_alpha_0to12_beta_100_N_6, 0.1:0.1:10.0)
# ╔═╡ 56304888-bd8d-43a4-996f-7f2967c06936
plot(0.1:0.1:10.0, real.(polaron_conductivity(frohlich_3d_alpha_0to12_beta_100_N_6_0to30)), ylims=(0,0.5))
# ╔═╡ 4c5b383f-1db5-40ae-8ab0-e3f7fbff501c
frohlich_3d_alpha_0to12_beta_100_N_7 = frohlich(αrange, 1.0, 100.0; v_guesses = [16,14,12,10,8,6,4], w_guesses = [15,13,11,9,7,5,3], upper = 2000.0)
# ╔═╡ d37d9cf6-037d-413a-961b-83bde3642892
begin
plot(αrange, reduce_array(frohlich_3d_alpha_0to12_beta_100_N_1.E .- frohlich_3d_alpha_0to12_beta_100_N_2.E), yaxis=:log)
plot!(αrange, reduce_array(frohlich_3d_alpha_0to12_beta_100_N_2.E .- frohlich_3d_alpha_0to12_beta_100_N_3.E))
plot!(αrange, reduce_array(frohlich_3d_alpha_0to12_beta_100_N_3.E .- frohlich_3d_alpha_0to12_beta_100_N_4.E))
plot!(αrange, reduce_array(frohlich_3d_alpha_0to12_beta_100_N_4.E .- frohlich_3d_alpha_0to12_beta_100_N_5.E))
plot!(αrange, reduce_array(frohlich_3d_alpha_0to12_beta_100_N_5.E .- frohlich_3d_alpha_0to12_beta_100_N_6.E))
plot!(αrange, reduce_array(frohlich_3d_alpha_0to12_beta_100_N_6.E .- frohlich_3d_alpha_0to12_beta_100_N_7.E))
end
# ╔═╡ cfc13eed-2322-4052-8075-e96354c56287
reduce_array(frohlich_3d_alpha_0to12_beta_100_N_6.E .- frohlich_3d_alpha_0to12_beta_100_N_7.E)
# ╔═╡ Cell order:
# ╠═711042e8-6520-11ef-1758-491cd566c023
# ╟─07d58ada-9abe-47cf-a7fb-96b96b700b10
# ╠═85d24807-1d4c-427b-9d4b-12d64f3464dc
# ╠═a6bae188-d450-45fa-a922-ea865628ba27
# ╟─bc56571f-e612-4fc0-89fd-626f604cfd45
# ╠═2027bdc8-95c0-4cfd-ad1c-c521f6d3e9f6
# ╠═4b6c74a7-adf4-4fdc-b3b8-0fcf724c7a97
# ╠═e64f1c29-f756-4e9e-8885-3bde4478804b
# ╠═05ad9aee-416b-4504-afd4-83f7798dc4f9
# ╠═b81a7e50-0645-4e0a-a539-974ea1947579
# ╠═88af9472-bc61-456c-a408-aea0524c4e0a
# ╠═c23a3621-e8ce-4852-8caf-f30cebfa6960
# ╠═5406d718-81ab-42e1-93a7-41e0158217c6
# ╟─d4609cdc-8457-4f5d-a254-b61d949b0b84
# ╠═8838e520-b35c-4fdb-9e9e-3f8519b89785
# ╠═9f176c24-b300-4738-ac3e-1eecfe752d07
# ╠═fcd11b51-124c-4513-86ae-3fd91afae836
# ╠═e5067fa5-ac6e-4092-a5b5-77dc57fd0946
# ╠═c51ff0e7-8d5e-40fe-8c31-742995d1a267
# ╠═a984c00a-fafa-438d-a793-0a6490e41863
# ╠═2fcf096c-5ef7-4b7f-b7d3-70e33961f9cb
# ╠═44e69331-2672-46a1-968d-2ec1435306e6
# ╠═7d8b473f-0290-4724-8deb-a390d72ce74d
# ╠═78d660b5-eb45-41a7-b292-4432e3aaae7e
# ╠═1554c91f-d325-4800-bc17-020491ed5c2e
# ╠═271f0b4e-224b-45f8-bd8b-5e8b9ae616be
# ╠═ef3eaac1-f9d7-4e8a-bd71-11c6992985f6
# ╠═de5cf838-1f44-461e-b7c6-9c31eb7f1c40
# ╠═3bbac0ae-c86c-4e0a-a460-d63b22991a44
# ╠═14c47316-b5fd-4d6c-a7d6-6ebda865f989
# ╠═ad676377-f6be-46a3-81fd-293f0085d2c7
# ╠═b10fb360-a44f-4372-bd7a-5c6a794a5be7
# ╠═03ac42ff-7a2c-4b61-a6d3-4500c4913080
# ╠═8bf786ef-4d7a-4a8f-bff0-245b3e31a30e
# ╠═88e8b2c6-0a36-4ce8-a36b-03a938209fb6
# ╠═404240e9-5f66-445e-a0ff-bfd6568fd23f
# ╠═9518e064-89f1-4205-b88c-c7894c48d4b9
# ╠═56c43383-0a6d-4bae-bdee-a3684848d169
# ╠═56304888-bd8d-43a4-996f-7f2967c06936
# ╠═4c5b383f-1db5-40ae-8ab0-e3f7fbff501c
# ╠═d37d9cf6-037d-413a-961b-83bde3642892
# ╠═cfc13eed-2322-4052-8075-e96354c56287