ICODE-ADC/lammps
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whitespace cleanup

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This commit is contained in:
Axel Kohlmeyer
2017-07-07 15:50:19 -04:00
parent fe888e4622
commit 71ddcaf0b6
1 changed files with 5 additions and 5 deletions
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10
src/compute_rdf.cpp
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@ -41,7 +41,7 @@ using namespace MathConst;
ComputeRDF::ComputeRDF(LAMMPS *lmp, int narg, char **arg) : ComputeRDF::ComputeRDF(LAMMPS *lmp, int narg, char **arg) :
Compute(lmp, narg, arg), Compute(lmp, narg, arg),
rdfpair(NULL), nrdfpair(NULL), ilo(NULL), ihi(NULL), jlo(NULL), jhi(NULL), rdfpair(NULL), nrdfpair(NULL), ilo(NULL), ihi(NULL), jlo(NULL), jhi(NULL),
hist(NULL), histall(NULL), typecount(NULL), icount(NULL), jcount(NULL), hist(NULL), histall(NULL), typecount(NULL), icount(NULL), jcount(NULL),
duplicates(NULL) duplicates(NULL)
{ {
if (narg < 4 || (narg-4) % 2) error->all(FLERR,"Illegal compute rdf command"); if (narg < 4 || (narg-4) % 2) error->all(FLERR,"Illegal compute rdf command");
@ -72,7 +72,7 @@ ComputeRDF::ComputeRDF(LAMMPS *lmp, int narg, char **arg) :
iarg += 2; iarg += 2;
} else error->all(FLERR,"Illegal compute rdf command"); } else error->all(FLERR,"Illegal compute rdf command");
} }
// pairwise args // pairwise args
if (nargpair == 0) npairs = 1; if (nargpair == 0) npairs = 1;
@ -162,12 +162,12 @@ void ComputeRDF::init()
mycutneigh = cutoff_user + skin; mycutneigh = cutoff_user + skin;
double cutghost; // as computed by Neighbor and Comm double cutghost; // as computed by Neighbor and Comm
if (force->pair) if (force->pair)
cutghost = MAX(force->pair->cutforce+skin,comm->cutghostuser); cutghost = MAX(force->pair->cutforce+skin,comm->cutghostuser);
else else
cutghost = comm->cutghostuser; cutghost = comm->cutghostuser;
if (mycutneigh > cutghost) if (mycutneigh > cutghost)
error->all(FLERR,"Compure rdf cutoff exceeds ghost atom range - " error->all(FLERR,"Compure rdf cutoff exceeds ghost atom range - "
"use comm_modify cutoff command"); "use comm_modify cutoff command");
if (force->pair && mycutneigh < force->pair->cutforce + skin) if (force->pair && mycutneigh < force->pair->cutforce + skin)