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
|
from ase.calculators.calculator import Calculator
def test_calculator_label():
calc = Calculator()
assert calc.directory == '.'
assert calc.prefix is None
assert calc.label is None
calc.label = 'dir/pref'
assert calc.directory == 'dir'
assert calc.prefix == 'pref'
assert calc.label == 'dir/pref'
calc.label = 'dir2/'
assert calc.directory == 'dir2'
assert calc.prefix is None
assert calc.label == 'dir2/'
calc.label = 'hello'
assert calc.directory == '.'
assert calc.prefix == 'hello'
assert calc.label == 'hello'
calc.label = None
assert calc.label is None
assert calc.prefix is None
assert calc.directory == '.'
|
