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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@638 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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This commit is contained in:
sjplimp
2007-06-21 18:58:43 +00:00
parent 59dda9f04b
commit ff535daa9f
46 changed files with 80 additions and 54 deletions
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10
src/atom.cpp
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@ -52,7 +52,7 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp)
nbonds = nangles = ndihedrals = nimpropers = 0;
bond_per_atom = angle_per_atom = dihedral_per_atom = improper_per_atom = 0;
// atom arrays
// initialize atom arrays
// customize by adding new array
tag = type = mask = image = NULL;
@ -82,6 +82,14 @@ Atom::Atom(LAMMPS *lmp) : Pointers(lmp)
improper_type = improper_atom1 = improper_atom2 = NULL;
improper_atom3 = improper_atom4 = NULL;
// initialize atom array existence flags
// customize by adding new flag
molecule_flag = 0;
q_flag = mu_flag = 0;
xphi_flag = quat_flag = omega_flag = angmom_flag = torque_flag = 0;
radius_flag = density_flag = rmass_flag = vfrac_flag = 0;
// ntype-length arrays
mass = NULL;