vasppy.grid module

class Grid(dimensions=(1, 1, 1))

Bases: object

average(normal_axis_label)

by_index(index)

cartesian_coordinate_at_index(index)

cube_slice(x0, y0, z0)

fractional_coordinate_at_index(index)

interpolate_to_orthorhombic_grid(dimensions)

interpolated_value_at_fractional_coordinate(coord)

projections = {'x': 0, 'y': 1, 'z': 2}

read_dimensions()

read_from_filename(filename)

read_grid()

write_dimensions()

write_grid()

write_to_filename(filename)

interpolate(i, j, x)

trilinear_interpolation(cube, r)