-
Notifications
You must be signed in to change notification settings - Fork 5
/
1.6.0-DEV-f05b821fe7.log
556 lines (552 loc) · 23.3 KB
/
1.6.0-DEV-f05b821fe7.log
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
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460
461
462
463
464
465
466
467
468
469
470
471
472
473
474
475
476
477
478
479
480
481
482
483
484
485
486
487
488
489
490
491
492
493
494
495
496
497
498
499
500
501
502
503
504
505
506
507
508
509
510
511
512
513
514
515
516
517
518
519
520
521
522
523
524
525
526
527
528
529
530
531
532
533
534
535
536
537
538
539
540
541
542
543
544
545
546
547
548
549
550
551
552
553
554
555
556
Julia Version 1.6.0-DEV.1218
Commit f05b821fe7 (2020-10-14 11:56 UTC)
Platform Info:
OS: Linux (x86_64-linux-gnu)
CPU: AMD EPYC 7502 32-Core Processor
WORD_SIZE: 64
LIBM: libopenlibm
LLVM: libLLVM-11.0.0 (ORCJIT, znver2)
Environment:
JULIA_DEPOT_PATH = ::/usr/local/share/julia
JULIA_NUM_THREADS = 2
JULIA_MAX_NUM_PRECOMPILE_FILES = 9223372036854775807
Resolving package versions...
Installed MbedTLS_jll ────────────────── v2.16.8+0
Installed CompilerSupportLibraries_jll ─ v0.3.3+0
Installed Mocking ────────────────────── v0.7.1
Installed DiffResults ────────────────── v1.0.2
Installed EzXML ──────────────────────── v1.1.0
Installed ExprTools ──────────────────── v0.1.2
Installed OrderedCollections ─────────── v1.3.1
Installed JuLIP ──────────────────────── v0.8.2
Installed Libiconv_jll ───────────────── v1.16.0+6
Installed DataAPI ────────────────────── v1.3.0
Installed Compat ─────────────────────── v3.20.0
Installed OpenSpecFun_jll ────────────── v0.5.3+3
Installed Dierckx ────────────────────── v0.4.2
Installed ArrayInterface ─────────────── v2.13.5
Installed Requires ───────────────────── v1.1.0
Installed LineSearches ───────────────── v7.1.0
Installed BinaryProvider ─────────────── v0.5.10
Installed XML2_jll ───────────────────── v2.9.10+2
Installed AlgebraicMultigrid ─────────── v0.3.0
Installed SpecialFunctions ───────────── v0.10.3
Installed DataStructures ─────────────── v0.18.7
Installed Missings ───────────────────── v0.4.4
Installed GitHub ─────────────────────── v5.1.7
Installed TimeZones ──────────────────── v1.4.0
Installed Optim ──────────────────────── v1.2.0
Installed Parsers ────────────────────── v1.0.11
Installed UnPack ─────────────────────── v1.0.2
Installed ForwardDiff ────────────────── v0.10.12
Installed StaticArrays ───────────────── v0.12.4
Installed IterativeSolvers ───────────── v0.8.4
Installed FillArrays ─────────────────── v0.9.7
Installed MacroTools ─────────────────── v0.5.5
Installed CommonSubexpressions ───────── v0.3.0
Installed Reexport ───────────────────── v0.2.0
Installed Calculus ───────────────────── v0.5.1
Installed PositiveFactorizations ─────── v0.2.3
Installed NaNMath ────────────────────── v0.3.4
Installed Parameters ─────────────────── v0.12.1
Installed NLSolversBase ──────────────── v7.7.1
Installed NeighbourLists ─────────────── v0.5.0
Installed HTTP ───────────────────────── v0.8.19
Installed DiffRules ──────────────────── v1.0.1
Installed RecipesBase ────────────────── v1.1.0
Installed Zlib_jll ───────────────────── v1.2.11+17
Installed IniFile ────────────────────── v0.5.0
Installed FunctionWrappers ───────────── v1.1.1
Installed JLLWrappers ────────────────── v1.1.2
Installed FiniteDiff ─────────────────── v2.7.0
Installed StatsBase ──────────────────── v0.33.2
Installed JSON ───────────────────────── v0.21.1
Installed SortingAlgorithms ──────────── v0.3.1
Installed MbedTLS ────────────────────── v1.0.2
Installed CompatHelper ───────────────── v1.16.2
Updating `~/.julia/environments/v1.6/Project.toml`
[945c410c] + JuLIP v0.8.2
Updating `~/.julia/environments/v1.6/Manifest.toml`
[2169fc97] + AlgebraicMultigrid v0.3.0
[4fba245c] + ArrayInterface v2.13.5
[b99e7846] + BinaryProvider v0.5.10
[49dc2e85] + Calculus v0.5.1
[bbf7d656] + CommonSubexpressions v0.3.0
[34da2185] + Compat v3.20.0
[aa819f21] + CompatHelper v1.16.2
[e66e0078] + CompilerSupportLibraries_jll v0.3.3+0
[9a962f9c] + DataAPI v1.3.0
[864edb3b] + DataStructures v0.18.7
[39dd38d3] + Dierckx v0.4.2
[163ba53b] + DiffResults v1.0.2
[b552c78f] + DiffRules v1.0.1
[e2ba6199] + ExprTools v0.1.2
[8f5d6c58] + EzXML v1.1.0
[1a297f60] + FillArrays v0.9.7
[6a86dc24] + FiniteDiff v2.7.0
[f6369f11] + ForwardDiff v0.10.12
[069b7b12] + FunctionWrappers v1.1.1
[bc5e4493] + GitHub v5.1.7
[cd3eb016] + HTTP v0.8.19
[83e8ac13] + IniFile v0.5.0
[42fd0dbc] + IterativeSolvers v0.8.4
[692b3bcd] + JLLWrappers v1.1.2
[682c06a0] + JSON v0.21.1
[945c410c] + JuLIP v0.8.2
[94ce4f54] + Libiconv_jll v1.16.0+6
[d3d80556] + LineSearches v7.1.0
[1914dd2f] + MacroTools v0.5.5
[739be429] + MbedTLS v1.0.2
[c8ffd9c3] + MbedTLS_jll v2.16.8+0
[e1d29d7a] + Missings v0.4.4
[78c3b35d] + Mocking v0.7.1
[d41bc354] + NLSolversBase v7.7.1
[77ba4419] + NaNMath v0.3.4
[2fcf5ba9] + NeighbourLists v0.5.0
[efe28fd5] + OpenSpecFun_jll v0.5.3+3
[429524aa] + Optim v1.2.0
[bac558e1] + OrderedCollections v1.3.1
[d96e819e] + Parameters v0.12.1
[69de0a69] + Parsers v1.0.11
[85a6dd25] + PositiveFactorizations v0.2.3
[3cdcf5f2] + RecipesBase v1.1.0
[189a3867] + Reexport v0.2.0
[ae029012] + Requires v1.1.0
[a2af1166] + SortingAlgorithms v0.3.1
[276daf66] + SpecialFunctions v0.10.3
[90137ffa] + StaticArrays v0.12.4
[2913bbd2] + StatsBase v0.33.2
[f269a46b] + TimeZones v1.4.0
[3a884ed6] + UnPack v1.0.2
[02c8fc9c] + XML2_jll v2.9.10+2
[83775a58] + Zlib_jll v1.2.11+17
[56f22d72] + Artifacts
[2a0f44e3] + Base64
[ade2ca70] + Dates
[8bb1440f] + DelimitedFiles
[8ba89e20] + Distributed
[b77e0a4c] + InteractiveUtils
[76f85450] + LibGit2
[8f399da3] + Libdl
[37e2e46d] + LinearAlgebra
[56ddb016] + Logging
[d6f4376e] + Markdown
[a63ad114] + Mmap
[44cfe95a] + Pkg
[de0858da] + Printf
[3fa0cd96] + REPL
[9a3f8284] + Random
[ea8e919c] + SHA
[9e88b42a] + Serialization
[1a1011a3] + SharedArrays
[6462fe0b] + Sockets
[2f01184e] + SparseArrays
[10745b16] + Statistics
[4607b0f0] + SuiteSparse
[fa267f1f] + TOML
[8dfed614] + Test
[cf7118a7] + UUIDs
[4ec0a83e] + Unicode
Building Dierckx ──→ `~/.julia/scratchspaces/44cfe95a-1eb2-52ea-b672-e2afdf69b78f/956bfe5c4f9b794545f6527424fc0294cc5decbe/build.log`
Building TimeZones → `~/.julia/scratchspaces/44cfe95a-1eb2-52ea-b672-e2afdf69b78f/2c48caca8f3912857973590a9757e1f86cbbff81/build.log`
Precompiling project... (tip: to disable auto-precompilation set ENV["JULIA_PKG_PRECOMPILE_AUTO"]=0)
[90m[32m ✓ [39mDataAPI[39m
[90m[32m ✓ [39mUnPack[39m
[90m[32m ✓ [39mReexport[39m
[90m[32m ✓ [39mIniFile[39m
[90m[32m ✓ [39mNaNMath[39m
[90m[32m ✓ [39mJLLWrappers[39m
[90m[32m ✓ [39mPositiveFactorizations[39m
[90m[32m ✓ [39mMissings[39m
[90m[32m ✓ [39mOrderedCollections[39m
[90m[32m ✓ [39mDierckx[39m
[90m[32m ✓ [39mFunctionWrappers[39m
[90m[32m ✓ [39mFillArrays[39m
[90m[32m ✓ [39mRequires[39m
[90m[32m ✓ [39mCompat[39m
[90m[32m ✓ [39mCalculus[39m
[90m[32m ✓ [39mParameters[39m
[90m[32m ✓ [39mCompilerSupportLibraries_jll[39m
[90m[32m ✓ [39mMbedTLS_jll[39m
[90m[32m ✓ [39mDataStructures[39m
[90m[32m ✓ [39mLibiconv_jll[39m
[90m[32m ✓ [39mZlib_jll[39m
[90m[32m ✓ [39mArrayInterface[39m
[90m[32m ✓ [39mSortingAlgorithms[39m
[90m[32m ✓ [39mMbedTLS[39m
[90m[32m ✓ [39mIterativeSolvers[39m
[90m[32m ✓ [39mStaticArrays[39m
[90m[32m ✓ [39mDiffResults[39m
[90m[32m ✓ [39mOpenSpecFun_jll[39m
[90m[32m ✓ [39mStatsBase[39m
[90m[32m ✓ [39mXML2_jll[39m
[90m[32m ✓ [39mNeighbourLists[39m
[90m[32m ✓ [39mMacroTools[39m
[90m[32m ✓ [39mParsers[39m
[90m[32m ✓ [39mFiniteDiff[39m
[90m[32m ✓ [39mEzXML[39m
[90m[32m ✓ [39mJSON[39m
[90m[32m ✓ [39mCommonSubexpressions[39m
[90m[32m ✓ [39mHTTP[39m
[90m[32m ✓ [39mSpecialFunctions[39m
[90m[32m ✓ [39mGitHub[39m
[90m[32m ✓ [39mTimeZones[39m
[90m[32m ✓ [39mDiffRules[39m
[90m[32m ✓ [39mCompatHelper[39m
[90m[32m ✓ [39mAlgebraicMultigrid[39m
[90m[32m ✓ [39mForwardDiff[39m
[90m[32m ✓ [39mNLSolversBase[39m
[90m[32m ✓ [39mLineSearches[39m
[90m[32m ✓ [39mOptim[39m
[32m ✓ [39mJuLIP
49 dependencies successfully precompiled (4 already precompiled)
Testing JuLIP
Status `/tmp/jl_Qf2DOY/Project.toml`
[2169fc97] AlgebraicMultigrid v0.3.0
[6e4b80f9] BenchmarkTools v0.5.0
[49dc2e85] Calculus v0.5.1
[bbf7d656] CommonSubexpressions v0.3.0
[39dd38d3] Dierckx v0.4.2
[f6369f11] ForwardDiff v0.10.12
[069b7b12] FunctionWrappers v1.1.1
[682c06a0] JSON v0.21.1
[945c410c] JuLIP v0.8.2
[d3d80556] LineSearches v7.1.0
[1914dd2f] MacroTools v0.5.5
[2fcf5ba9] NeighbourLists v0.5.0
[429524aa] Optim v1.2.0
[189a3867] Reexport v0.2.0
[90137ffa] StaticArrays v0.12.4
[8bb1440f] DelimitedFiles
[37e2e46d] LinearAlgebra
[de0858da] Printf
[2f01184e] SparseArrays
[4607b0f0] SuiteSparse
[8dfed614] Test
Status `/tmp/jl_Qf2DOY/Manifest.toml`
[2169fc97] AlgebraicMultigrid v0.3.0
[4fba245c] ArrayInterface v2.13.5
[6e4b80f9] BenchmarkTools v0.5.0
[b99e7846] BinaryProvider v0.5.10
[49dc2e85] Calculus v0.5.1
[bbf7d656] CommonSubexpressions v0.3.0
[34da2185] Compat v3.20.0
[aa819f21] CompatHelper v1.16.2
[e66e0078] CompilerSupportLibraries_jll v0.3.3+0
[9a962f9c] DataAPI v1.3.0
[864edb3b] DataStructures v0.18.7
[39dd38d3] Dierckx v0.4.2
[163ba53b] DiffResults v1.0.2
[b552c78f] DiffRules v1.0.1
[e2ba6199] ExprTools v0.1.2
[8f5d6c58] EzXML v1.1.0
[1a297f60] FillArrays v0.9.7
[6a86dc24] FiniteDiff v2.7.0
[f6369f11] ForwardDiff v0.10.12
[069b7b12] FunctionWrappers v1.1.1
[bc5e4493] GitHub v5.1.7
[cd3eb016] HTTP v0.8.19
[83e8ac13] IniFile v0.5.0
[42fd0dbc] IterativeSolvers v0.8.4
[692b3bcd] JLLWrappers v1.1.2
[682c06a0] JSON v0.21.1
[945c410c] JuLIP v0.8.2
[94ce4f54] Libiconv_jll v1.16.0+6
[d3d80556] LineSearches v7.1.0
[1914dd2f] MacroTools v0.5.5
[739be429] MbedTLS v1.0.2
[c8ffd9c3] MbedTLS_jll v2.16.8+0
[e1d29d7a] Missings v0.4.4
[78c3b35d] Mocking v0.7.1
[d41bc354] NLSolversBase v7.7.1
[77ba4419] NaNMath v0.3.4
[2fcf5ba9] NeighbourLists v0.5.0
[efe28fd5] OpenSpecFun_jll v0.5.3+3
[429524aa] Optim v1.2.0
[bac558e1] OrderedCollections v1.3.1
[d96e819e] Parameters v0.12.1
[69de0a69] Parsers v1.0.11
[85a6dd25] PositiveFactorizations v0.2.3
[3cdcf5f2] RecipesBase v1.1.0
[189a3867] Reexport v0.2.0
[ae029012] Requires v1.1.0
[a2af1166] SortingAlgorithms v0.3.1
[276daf66] SpecialFunctions v0.10.3
[90137ffa] StaticArrays v0.12.4
[2913bbd2] StatsBase v0.33.2
[f269a46b] TimeZones v1.4.0
[3a884ed6] UnPack v1.0.2
[02c8fc9c] XML2_jll v2.9.10+2
[83775a58] Zlib_jll v1.2.11+17
[56f22d72] Artifacts
[2a0f44e3] Base64
[ade2ca70] Dates
[8bb1440f] DelimitedFiles
[8ba89e20] Distributed
[b77e0a4c] InteractiveUtils
[76f85450] LibGit2
[8f399da3] Libdl
[37e2e46d] LinearAlgebra
[56ddb016] Logging
[d6f4376e] Markdown
[a63ad114] Mmap
[44cfe95a] Pkg
[de0858da] Printf
[3fa0cd96] REPL
[9a3f8284] Random
[ea8e919c] SHA
[9e88b42a] Serialization
[1a1011a3] SharedArrays
[6462fe0b] Sockets
[2f01184e] SparseArrays
[10745b16] Statistics
[4607b0f0] SuiteSparse
[fa267f1f] TOML
[8dfed614] Test
[cf7118a7] UUIDs
[4ec0a83e] Unicode
Testing Running tests...
≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡
JuLIP Tests
≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡≡
[ Info: preparing the tests...
[ Info: Loading some interatomic potentials . .
. . done.
[ Info: on CI : don't run solver tests
=======================
Testset Miscellaneous
=======================
==========
Test Aux
==========
--------------------------
matrix <-> vec conversions
--------------------------
Test Passed
Test Passed
Test Passed
Test Passed
Test Passed
===============
Testset Atoms
===============
check that `bulk` evaluates ok...
Test Passed
... and that we can repeat it.
Test Passed
check deepcopy and == ...
Test Passed
Check setindex! and getindex ...
Test Passed
┌ Warning: `a::StaticArray + b::Number` is deprecated, use `a .+ b` instead.
│ caller = top-level scope at test_atoms.jl:23
└ @ Core ~/.julia/packages/JuLIP/WO5HB/test/test_atoms.jl:23
Test Passed
Test Passed
set_positions ...
Test Passed
Test Passed
Test Passed
Test Passed
Test Passed
Test Passed
Test Passed
test set_positions!
Test Passed
Test Passed
test set_momenta!
Test Passed
test set_dofs!, etc
Test Passed
Test Passed
Test Passed
Test Passed
===============
Testset Build
===============
=================
Testset File IO
=================
Testing single `Atoms` <-> `Dict`
Test Passed
Test Passed
Test JSON fio
Test Passed
Test array of Atoms <-> Dict
Test Passed
Test JSON fio for array
Test Passed
============================
Testset Analytic Potential
============================
generate hand-coded morse potential
generate AD morse potential
typeof(morse1) = AnalyticFunction{var"#3#6"{Float64, Float64, Float64}, var"#4#7"{Float64, Float64, Float64}, var"#5#8"{Float64, Float64, Float64}}
Check consistency of hand-coded and analytic Morse potentials...
Test Passed
Test Passed
------------------------------------------
Performance tests: @analytic vs hand-coded
------------------------------------------
Evaluations of @analytic Potential
49.559 μs (1000 allocations: 109.38 KiB)
Evaluations hand-coded Potential
52.829 μs (1000 allocations: 109.38 KiB)
Grad of @analytic Potential
81.828 μs (2000 allocations: 218.75 KiB)
Grad of hand-coded Potential
83.959 μs (2000 allocations: 218.75 KiB)
====================
Testset Potentials
====================
--------------------------------------
Testing pair potential implementations
--------------------------------------
AnalyticFunction{JuLIP.Potentials.var"#16#19"{Float64, Float64}, JuLIP.Potentials.var"#17#20"{Float64, Float64}, JuLIP.Potentials.var"#18#21"{Float64, Float64}}(JuLIP.Potentials.var"#16#19"{Float64, Float64}(1.0, 1.0), JuLIP.Potentials.var"#17#20"{Float64, Float64}(1.0, 1.0), JuLIP.Potentials.var"#18#21"{Float64, Float64}(1.0, 1.0))
---------|-----------
h | error
---------|-----------
1.0e-02 | 6.21e+01
1.0e-03 | 6.55e+00
1.0e-04 | 6.59e-01
1.0e-05 | 6.59e-02
1.0e-06 | 6.59e-03
1.0e-07 | 6.59e-04
1.0e-08 | 5.85e-05
1.0e-09 | 3.10e-05
1.0e-10 | 4.79e-04
1.0e-11 | 4.01e-03
---------|-----------
passed
Test Passed
AnalyticFunction{JuLIP.Potentials.var"#25#28"{Float64, Float64, Float64}, JuLIP.Potentials.var"#26#29"{Float64, Float64, Float64}, JuLIP.Potentials.var"#27#30"{Float64, Float64, Float64}}(JuLIP.Potentials.var"#25#28"{Float64, Float64, Float64}(4.0, 1.0, 1.0), JuLIP.Potentials.var"#26#29"{Float64, Float64, Float64}(4.0, 1.0, 1.0), JuLIP.Potentials.var"#27#30"{Float64, Float64, Float64}(4.0, 1.0, 1.0))
---------|-----------
h | error
---------|-----------
1.0e-02 | 1.19e+00
1.0e-03 | 1.23e-01
1.0e-04 | 1.23e-02
1.0e-05 | 1.23e-03
1.0e-06 | 1.23e-04
1.0e-07 | 1.23e-05
1.0e-08 | 1.13e-06
1.0e-09 | 3.33e-07
1.0e-10 | 4.64e-06
1.0e-11 | 3.61e-05
---------|-----------
passed
Test Passed
JuLIP.Potentials.ProdPot{SWCutoff{Float64}, AnalyticFunction{JuLIP.Potentials.var"#16#19"{Float64, Float64}, JuLIP.Potentials.var"#17#20"{Float64, Float64}, JuLIP.Potentials.var"#18#21"{Float64, Float64}}}(SWCutoff{Float64}(1.0, 3.0, 1.0), AnalyticFunction{JuLIP.Potentials.var"#16#19"{Float64, Float64}, JuLIP.Potentials.var"#17#20"{Float64, Float64}, JuLIP.Potentials.var"#18#21"{Float64, Float64}}(JuLIP.Potentials.var"#16#19"{Float64, Float64}(1.0, 1.0), JuLIP.Potentials.var"#17#20"{Float64, Float64}(1.0, 1.0), JuLIP.Potentials.var"#18#21"{Float64, Float64}(1.0, 1.0)))
---------|-----------
h | error
---------|-----------
1.0e-02 | 7.17e-04
1.0e-03 | 8.77e-05
1.0e-04 | 8.96e-06
1.0e-05 | 8.98e-07
1.0e-06 | 8.98e-08
1.0e-07 | 8.98e-09
1.0e-08 | 8.85e-10
1.0e-09 | 1.34e-10
1.0e-10 | 4.96e-10
1.0e-11 | 9.95e-10
---------|-----------
passed
Test Passed
JuLIP.Potentials.ProdPot{SplineCutoff, AnalyticFunction{JuLIP.Potentials.var"#16#19"{Float64, Float64}, JuLIP.Potentials.var"#17#20"{Float64, Float64}, JuLIP.Potentials.var"#18#21"{Float64, Float64}}}(SplineCutoff(2.0, 3.0), AnalyticFunction{JuLIP.Potentials.var"#16#19"{Float64, Float64}, JuLIP.Potentials.var"#17#20"{Float64, Float64}, JuLIP.Potentials.var"#18#21"{Float64, Float64}}(JuLIP.Potentials.var"#16#19"{Float64, Float64}(1.0, 1.0), JuLIP.Potentials.var"#17#20"{Float64, Float64}(1.0, 1.0), JuLIP.Potentials.var"#18#21"{Float64, Float64}(1.0, 1.0)))
---------|-----------
h | error
---------|-----------
1.0e-02 | 6.21e+01
1.0e-03 | 6.55e+00
1.0e-04 | 6.59e-01
1.0e-05 | 6.59e-02
1.0e-06 | 6.59e-03
1.0e-07 | 6.59e-04
1.0e-08 | 5.85e-05
1.0e-09 | 3.10e-05
1.0e-10 | 4.79e-04
1.0e-11 | 4.01e-03
---------|-----------
passed
Test Passed
C2Shift{AnalyticFunction{JuLIP.Potentials.var"#16#19"{Float64, Float64}, JuLIP.Potentials.var"#17#20"{Float64, Float64}, JuLIP.Potentials.var"#18#21"{Float64, Float64}}, Float64}(Val{2}(), AnalyticFunction{JuLIP.Potentials.var"#16#19"{Float64, Float64}, JuLIP.Potentials.var"#17#20"{Float64, Float64}, JuLIP.Potentials.var"#18#21"{Float64, Float64}}(JuLIP.Potentials.var"#16#19"{Float64, Float64}(1.0, 1.0), JuLIP.Potentials.var"#17#20"{Float64, Float64}(1.0, 1.0), JuLIP.Potentials.var"#18#21"{Float64, Float64}(1.0, 1.0)), 2.0, -0.0615234375, 0.181640625, -0.6181640625)
---------|-----------
h | error
---------|-----------
1.0e-02 | 6.21e+01
1.0e-03 | 6.55e+00
1.0e-04 | 6.59e-01
1.0e-05 | 6.59e-02
1.0e-06 | 6.59e-03
1.0e-07 | 6.59e-04
1.0e-08 | 5.84e-05
1.0e-09 | 2.90e-05
1.0e-10 | 4.62e-04
1.0e-11 | 4.01e-03
---------|-----------
passed
Test Passed
ZBLPotential{AnalyticFunction{JuLIP.Potentials.var"#33#36"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}, JuLIP.Potentials.var"#34#37"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}, JuLIP.Potentials.var"#35#38"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}}}(5, 8, AnalyticFunction{JuLIP.Potentials.var"#33#36"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}, JuLIP.Potentials.var"#34#37"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}, JuLIP.Potentials.var"#35#38"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}}(JuLIP.Potentials.var"#33#36"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}(1.3176385984042092, 6.158783984505388, 20.9148983873684, 0.02817, 0.2802, 0.5099, 0.1818, 575.985814118274), JuLIP.Potentials.var"#34#37"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}(1.3176385984042092, 6.158783984505388, 20.9148983873684, 0.02817, 0.2802, 0.5099, 0.1818, 575.985814118274), JuLIP.Potentials.var"#35#38"{Float64, Float64, Float64, Float64, Float64, Float64, Float64, Float64}(1.3176385984042092, 6.158783984505388, 20.9148983873684, 0.02817, 0.2802, 0.5099, 0.1818, 575.985814118274)))
---------|-----------
h | error
---------|-----------
1.0e-02 | 3.84e+00
1.0e-03 | 3.90e-01
1.0e-04 | 3.91e-02
1.0e-05 | 3.91e-03
1.0e-06 | 3.91e-04
1.0e-07 | 3.92e-05
1.0e-08 | 3.01e-06
1.0e-09 | 2.23e-05
1.0e-10 | 2.15e-04
1.0e-11 | 1.27e-03
---------|-----------
passed
Test Passed
-----------------------
testing shift-cutoffs:
-----------------------
HS
Test Passed
Test Passed
V0
Test Passed
Test Passed
V1
Test Passed
Test Passed
V2
Test Passed
Test Passed
----------------------------------
Testing calculator implementations
----------------------------------
--------------------------------
JuLIP.Potentials.ProdPot{SplineCutoff, AnalyticFunction{JuLIP.Potentials.var"#16#19"{Float64, Float64}, JuLIP.Potentials.var"#17#20"{Float64, Float64}, JuLIP.Potentials.var"#18#21"{Float64, Float64}}}
length(at_) = 72
┌ Warning: `a::StaticArray + b::Number` is deprecated, use `a .+ b` instead.
│ caller = position_to_cell_index at cell_list.jl:48 [inlined]
└ @ Core ~/.julia/packages/NeighbourLists/mW4WV/src/cell_list.jl:48
┌ Warning: `a::StaticArray + b::Number` is deprecated, use `a .+ b` instead.
│ caller = position_to_cell_index at cell_list.jl:48 [inlined]
└ @ Core ~/.julia/packages/NeighbourLists/mW4WV/src/cell_list.jl:48
┌ Warning: `a::StaticArray - b::Number` is deprecated, use `a .- b` instead.
│ caller = _find_neighbours_!(i::Int64, clist::NeighbourLists.CellList{Float64, Int32}, ns_vec::StaticArrays.SVector{3, Int32}, bins::StaticArrays.SMatrix{3, 3, Float64, 9}, xyz_range::CartesianIndices{3, Tuple{UnitRange{Int64}, UnitRange{Int64}, UnitRange{Int64}}}, first::Vector{Int32}, secnd::Vector{Int32}, shift::Vector{StaticArrays.SVector{3, Int32}}) at cell_list.jl:235
└ @ NeighbourLists ~/.julia/packages/NeighbourLists/mW4WV/src/cell_list.jl:235
┌ Warning: `a::StaticArray + b::Number` is deprecated, use `a .+ b` instead.
│ caller = position_to_cell_index at cell_list.jl:48 [inlined]
└ @ Core ~/.julia/packages/NeighbourLists/mW4WV/src/cell_list.jl:48
┌ Warning: `a::StaticArray - b::Number` is deprecated, use `a .- b` instead.
│ caller = _find_neighbours_!(i::Int64, clist::NeighbourLists.CellList{Float64, Int32}, ns_vec::StaticArrays.SVector{3, Int32}, bins::StaticArrays.SMatrix{3, 3, Float64, 9}, xyz_range::CartesianIndices{3, Tuple{UnitRange{Int64}, UnitRange{Int64}, UnitRange{Int64}}}, first::Vector{Int32}, secnd::Vector{Int32}, shift::Vector{StaticArrays.SVector{3, Int32}}) at cell_list.jl:266
└ @ NeighbourLists ~/.julia/packages/NeighbourLists/mW4WV/src/cell_list.jl:266
---------|-----------
h | error
---------|-----------
signal (15): Terminated
in expression starting at none:31
pthread_cond_wait at /lib/x86_64-linux-gnu/libpthread.so.0 (unknown line)
signal (15): Terminated
in expression starting at /home/pkgeval/.julia/packages/JuLIP/WO5HB/test/testpotentials.jl:109
pthread_cond_wait at /lib/x86_64-linux-gnu/libpthread.so.0 (unknown line)
uv_cond_wait at /workspace/srcdir/libuv/src/unix/thread.c:847