Fix typos

docs/examples/example_si222.md

@@ -210,7 +210,7 @@ Path in the primitive cell:
    W         : 38   
    X         : 50   
    \Gamma    : 73   
-Unfolding had been performed - use `unfold plot` to plot the spectral function.
+Unfolding has been performed - use `unfold plot` to plot the spectral function.
 ```
 
 Note that in most cases one would always want to include the additional kpoints to correctly capture the effect of symmetry breaking.

easyunfold/cli.py

@@ -214,7 +214,7 @@ def unfold_status(ctx):
         click.echo(f'   {label:<10}: {index+1:<5}')
 
     if unfoldset.is_calculated:
-        click.echo('Unfolding had been performed - use `unfold plot` to plot the spectral function.')
+        click.echo('Unfolding has been performed - use `unfold plot` to plot the spectral function.')
     else:
         click.echo('Please run the supercell band structure calculation and run `unfold calculate`.')
 
@@ -305,7 +305,7 @@ def unfold_effective_mass(ctx, intensity_threshold, spin, band_filter, npoints,
     for mode in ['cbm', 'vbm']:
         for kid, subkid, iband in zip(*efm.get_band_extrema(mode=mode)):
             band_idx = ','.join(map(str, iband))
-            table.append([kid, mode, subkid, band_idx])
+            table.append([kid, mode.upper(), subkid, band_idx])
     click.echo(tabulate(table, headers=['Kpoint index', 'Kind', 'Sub-kpoint index', 'Band indices']))
     click.echo('')
 
@@ -331,7 +331,7 @@ def print_data(entries, tag='me'):
         """Print the effective mass data"""
         table = []
         for i, entry in enumerate(entries):
-            me = entry['effective_mass']
+            me = round(entry['effective_mass'], 3)
 
             kf = entry['kpoint_from']
             lf = entry['kpoint_label_from']

tests/test_cli.py

@@ -207,7 +207,7 @@ def test_unfold(si_project_dir, tag):
     args_calc = ['unfold', '--data-file', 'test.json', 'status']
     output = runner.invoke(easyunfold, args_calc)
     assert output.exit_code == 0
-    assert 'had been performed' in output.stdout
+    assert 'has been performed' in output.stdout
 
     unfoldset = loadfn('test.json')