Fix more typos in tools (08baaa9d) · Commits · 郑智淋 / lammps

tools/i-pi/drivers/driver.f90

+1 −1

Original line number	Diff line number	Diff line
		@@ -67,7 +67,7 @@
		INTEGER i

		! parse the command line parameters
		! intialize defaults
		! initialize defaults
		ccmd = 0
		inet = 1
		host = "localhost"//achar(0)

+1 −1

Original line number	Diff line number	Diff line
		@@ -120,7 +120,7 @@ class Atoms(dobject):

		Each replica and the centroid coordinate are all held as Atoms objects,
		and so slices of the global position and momentum arrays must be used in
		the initialisation so that they always agree with each other.
		the initialization so that they always agree with each other.

		Args:
		natoms: An integer giving the number of atoms.

+2 −2

Original line number	Diff line number	Diff line
		@@ -460,7 +460,7 @@ class Properties(dobject):
		key: A string contained in property_dict.

		Returns:
		The property labelled by the keyword key, along with its unit
		The property labeled by the keyword key, along with its unit
		keyword, and the argument lists for the function used to calculate
		the property specified by the keyword key.
		"""
		@@ -1216,7 +1216,7 @@ class Trajectories(dobject):
		key: A string contained in trajectory_dict.

		Returns:
		The trajectory labelled by the keyword key, along with its unit
		The trajectory labeled by the keyword key, along with its unit
		keyword, and the argument lists for the function used to calculate
		the trajectory specified by the keyword key.
		"""

+1 −1

Original line number	Diff line number	Diff line
		@@ -49,7 +49,7 @@ class Simulation(dobject):
		"""Main simulation object.

		Contains all the references and the main dynamics loop. Also handles the
		initialisation and output.
		initialization and output.

		Attributes:
		beads: A beads object giving the atom positions.

+3 −3

Original line number	Diff line number	Diff line
		@@ -243,7 +243,7 @@ class DriverSocket(socket.socket):
		return np.fromstring(self._buf[0:blen], dest.dtype).reshape(dest.shape)

		def initialize(self, rid, pars):
		"""Sends the initialisation string to the driver.
		"""Sends the initialization string to the driver.

		Args:
		rid: The index of the request, i.e. the replica that
		@@ -456,13 +456,13 @@ class InterfaceSocket(object):
		"""Adds a request.

		Note that the pars dictionary need to be sent as a string of a
		standard format so that the initialisation of the driver can be done.
		standard format so that the initialization of the driver can be done.

		Args:
		atoms: An Atoms object giving the atom positions.
		cell: A Cell object giving the system box.
		pars: An optional dictionary giving the parameters to be sent to the
		driver for initialisation. Defaults to {}.
		driver for initialization. Defaults to {}.
		reqid: An optional integer that identifies requests of the same type,
		e.g. the bead index