Patch of class2 dihedral (599a1895) · Commits · 郑智淋 / lammps

src/CLASS2/dihedral_class2.cpp

+4 −1

Original line number	Diff line number	Diff line
		@@ -2,10 +2,12 @@
		LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
		http://lammps.sandia.gov, Sandia National Laboratories
		Steve Plimpton, sjplimp@sandia.gov

		Copyright (2003) Sandia Corporation. Under the terms of Contract
		DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
		certain rights in this software. This software is distributed under
		the GNU General Public License.

		See the README file in the top-level LAMMPS directory.
		------------------------------------------------------------------------- */

		@@ -962,3 +964,4 @@ void DihedralClass2::write_data(FILE *fp)
		at_f1_2[i],at_f2_2[i],at_f3_2[i],
		at_theta0_1[i]180.0/MY_PI,at_theta0_2[i]180.0/MY_PI);
		}