Coverage report:
99%
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Files
Functions
Classes
coverage.py v7.16.0
, created at 2026-10-08 12:52 +0000
Statements
Branches
Total
File
class
coverage
statements
missing
excluded
coverage
branches
partial
coverage
calorine
/
__init__.py
(no class)
100%
1
0
0
100%
0
0
100%
calorine
/
calculators
/
__init__.py
(no class)
100%
3
0
0
100%
0
0
100%
calorine
/
calculators
/
_dftd3.py
(no class)
100%
27
0
0
100%
16
0
100%
calorine
/
calculators
/
cpunep.py
CPUNEP
100%
172
0
3
100%
76
0
100%
calorine
/
calculators
/
cpunep.py
(no class)
100%
40
0
0
100%
0
0
100%
calorine
/
calculators
/
gpunep.py
GPUMDShellProfile
100%
5
0
0
100%
2
0
100%
calorine
/
calculators
/
gpunep.py
GPUNEP
100%
142
0
0
100%
74
0
100%
calorine
/
calculators
/
gpunep.py
(no class)
100%
49
0
0
100%
0
0
100%
calorine
/
env.py
(no class)
100%
7
0
0
100%
2
0
100%
calorine
/
gpumd
/
__init__.py
(no class)
100%
2
0
0
100%
0
0
100%
calorine
/
gpumd
/
_header.py
_HeaderBlock
100%
0
0
0
100%
0
0
100%
calorine
/
gpumd
/
_header.py
_GpumdHeader
100%
0
0
0
100%
0
0
100%
calorine
/
gpumd
/
_header.py
(no class)
98%
132
2
0
97%
68
2
98%
calorine
/
gpumd
/
io.py
(no class)
99%
283
1
0
98%
114
2
99%
calorine
/
nep
/
__init__.py
(no class)
100%
5
0
0
100%
0
0
100%
calorine
/
nep
/
io.py
_ParityProperty
100%
0
0
0
100%
0
0
100%
calorine
/
nep
/
io.py
(no class)
100%
278
0
0
100%
152
0
100%
calorine
/
nep
/
model.py
Model
99%
553
2
0
99%
328
2
99%
calorine
/
nep
/
model.py
(no class)
100%
544
0
0
100%
242
0
100%
calorine
/
nep
/
nep.py
(no class)
100%
323
0
0
100%
106
0
100%
calorine
/
nep
/
tensor_conventions.py
(no class)
100%
13
0
0
100%
0
0
100%
calorine
/
nep
/
training_factory.py
(no class)
100%
98
0
0
100%
52
0
100%
calorine
/
tools
/
__init__.py
(no class)
100%
10
0
0
100%
0
0
100%
calorine
/
tools
/
analysis.py
(no class)
100%
56
0
0
100%
16
0
100%
calorine
/
tools
/
entropy.py
(no class)
100%
71
0
30
100%
16
0
100%
calorine
/
tools
/
kramers_kronig.py
(no class)
100%
41
0
0
100%
10
0
100%
calorine
/
tools
/
phonons.py
(no class)
100%
26
0
4
100%
2
0
100%
calorine
/
tools
/
prediction.py
(no class)
100%
84
0
0
100%
34
0
100%
calorine
/
tools
/
refractive_index.py
(no class)
100%
81
0
0
100%
40
0
100%
calorine
/
tools
/
spectra.py
(no class)
100%
183
0
0
100%
58
0
100%
calorine
/
tools
/
stiffness.py
(no class)
100%
41
0
0
100%
10
0
100%
calorine
/
tools
/
structures.py
(no class)
100%
79
0
9
100%
28
0
100%
Total
99%
3349
5
46
99%
1446
6
99%
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