def compute_tangents(self, y):
nebm_clib.compute_tangents(self.tangents, y, self.energies,
self.n_dofs_image, self.n_images)
nebm_cartesian.project_images(self.tangents, y, self.n_images,
self.n_dofs_image)
nebm_cartesian.normalise_images(self.tangents, self.n_images,
self.n_dofs_image)
def compute_tangents(self, y):
nebm_clib.compute_tangents(self.tangents, y, self.energies,
self.n_dofs_image, self.n_images
)
nebm_cartesian.normalise_images(self.tangents,
self.n_images, self.n_dofs_image
)
def compute_tangents(self, y):
"""
Calculation of tangents from the Geodesic NEBM, so we can use the
interpolation methods for the energy band
TODO: An alternative approximation of the band can be made with simple
spline interpolations although the GNEBM interpolation has more
information of the gradients
"""
nebm_clib.compute_tangents(self.tangents, y, self.energies,
self.n_dofs_image, self.n_images
)
nebm_clib.project_images(self.tangents, y,
self.n_images, self.n_dofs_image
)
nebm_clib.normalise_images(self.tangents,
self.n_images, self.n_dofs_image
)
def compute_tangents(self, y):
nebm_clib.compute_tangents(self.tangents, y, self.energies,
self.n_dofs_image, self.n_images
)
def compute_tangents(self, y):
nebm_clib.compute_tangents(self.tangents, y, self.energies,
self.n_dofs_image, self.n_images
)