本文整理汇总了Python中pylada.vasp.Vasp.smearings方法的典型用法代码示例。如果您正苦于以下问题：Python Vasp.smearings方法的具体用法？Python Vasp.smearings怎么用？Python Vasp.smearings使用的例子？那么恭喜您, 这里精选的方法代码示例或许可以为您提供帮助。您也可以进一步了解该方法所在类pylada.vasp.Vasp的用法示例。
在下文中一共展示了Vasp.smearings方法的1个代码示例，这些例子默认根据受欢迎程度排序。您可以为喜欢或者感觉有用的代码点赞，您的评价将有助于系统推荐出更棒的Python代码示例。
示例1: test_typed
# 需要导入模块: from pylada.vasp import Vasp [as 别名]
# 或者: from pylada.vasp.Vasp import smearings [as 别名]
def test_typed():
from pylada.vasp import Vasp
from pylada.error import ValueError
a = Vasp()
assert a.nbands is None
assert a._input['nbands'].keyword == 'nbands'
assert a._input['nbands'].output_map() is None
a.nbands = 50
assert a.nbands == 50
assert 'nbands' in a._input['nbands'].output_map()
assert a._input['nbands'].output_map()['nbands'] == str(a.nbands)
a.nbands = '51'
assert a.nbands == 51
assert 'nbands' in a._input['nbands'].output_map()
assert a._input['nbands'].output_map()['nbands'] == str(a.nbands)
a.nbands = None
assert a.nbands is None
assert a._input['nbands'].output_map() is None
try: a.nbands = 'a'
except ValueError: pass
else: raise Exception()
assert a.smearings is None
assert a._input['smearings'].keyword == 'smearings'
assert a._input['smearings'].output_map() is None
a.smearings = [1.5, 1.0, 0.5]
assert len(a.smearings) == 3
assert all(abs(i-v) < 1e-8 for i, v in zip(a.smearings, [1.5, 1.0, 0.5]))
assert 'smearings' in a._input['smearings'].output_map()
assert all(abs(float(i)-v) < 1e-8 for i, v in zip(a._input['smearings'].output_map()['smearings'].split(), [1.5, 1.0, 0.5]))
a.smearings = ['1.2', '0.2']
assert len(a.smearings) == 2
assert all(abs(i-v) < 1e-8 for i, v in zip(a.smearings, [1.2, 0.2]))
assert 'smearings' in a._input['smearings'].output_map()
assert all(abs(float(i)-v) < 1e-8 for i, v in zip(a._input['smearings'].output_map()['smearings'].split(), [1.2, 0.2]))
a.smearings = '1.3 0.3'
assert len(a.smearings) == 2
assert all(abs(i-v) < 1e-8 for i, v in zip(a.smearings, [1.3, 0.3]))
assert 'smearings' in a._input['smearings'].output_map()
assert all(abs(float(i)-v) < 1e-8 for i, v in zip(a._input['smearings'].output_map()['smearings'].split(), [1.3, 0.3]))
a.smearings = '1.3, 0.3'
assert len(a.smearings) == 2
assert all(abs(i-v) < 1e-8 for i, v in zip(a.smearings, [1.3, 0.3]))
a.smearings = '1.3; 0.3'
assert len(a.smearings) == 2
assert all(abs(i-v) < 1e-8 for i, v in zip(a.smearings, [1.3, 0.3]))
a.smearings = None
assert a.smearings is None
assert a._input['smearings'].output_map() is None
try: a.smearings = 5.5
except ValueError: pass
else: raise Exception()
try: a.smearings = [5.5, 'a']
except ValueError: pass
else: raise Exception()