#  Please cite the following publication for the use of LAMMPS-COMB3.
 #  Tao Liang, Tzu-Ray Shan, Yu-Ting Cheng, Bryce D. Devine, Mark Noordhoek, Yangzhong Li, Zhize Lu, Simon R. Phillpot,and  Susan B. Sinnott, "Classical atomistic simulations of surfaces and heterogeneous interfaces with the charge-optimized many body (COMB) potentials", Materials Science and Engineering: Reports, 74 (2013) 255-279.

 # For further information, please contact
 ########################################
 #  Tao Liang
 #
 #  319 Stiedle Building
 #  Pennsylvania State University
 #  State College, PA 16802
 #  USA
 #
 #  email: tul17@...122...
 #  Phone: 01(312)493-0166
 ######################################

The tarball file contains COMB3 implementation at LAMMPS (compatable with
Dec. 2014 or after).

 Four folders are included:
    doc: documentation of COMB implementation
    src: source codes for COMBs
    potentials: parameter sets for COMB3 force field
       ffield.comb3: standard parameter set
       lib.comb3: special parameter set for carbon-hydrogen-oxygen force fields. Need to be copied to working directory
    example: an application of COMB3. Results are shown in log.lammps. 

 Downloaded the latest LAMMPS from LAMMPS website
 copy COMBs source codes inside 'src' folder to LAMMPS 'src' folder
 then make 

 For usage of fix_qeq/comb or fix_qeq/ecomb, please read the readme.fixqeq.txt and readme.ecomb.txt.

 Use the parameter files (ffield.comb3 and lib.comb3) from folder 'potentials'.
 Do NOT use these two files from the same foldername in LAMMPS.