git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12956 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2015-01-19 23:43:48 +00:00
parent e72afc5488
commit 72ac6ea854
21 changed files with 21 additions and 21 deletions

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@ -246,7 +246,7 @@ void FixBondCreate::init()
// need a half neighbor list, built every Nevery steps // need a half neighbor list, built every Nevery steps
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->fix = 1; neighbor->requests[irequest]->fix = 1;
neighbor->requests[irequest]->occasional = 1; neighbor->requests[irequest]->occasional = 1;

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@ -166,7 +166,7 @@ void FixBondSwap::init()
// need a half neighbor list, built every Nevery steps // need a half neighbor list, built every Nevery steps
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->fix = 1; neighbor->requests[irequest]->fix = 1;
neighbor->requests[irequest]->occasional = 1; neighbor->requests[irequest]->occasional = 1;

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@ -212,7 +212,7 @@ void FixOrientFCC::init()
// need a full neighbor list, built whenever re-neighboring occurs // need a full neighbor list, built whenever re-neighboring occurs
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->fix = 1; neighbor->requests[irequest]->fix = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -119,7 +119,7 @@ void FixPeriNeigh::init()
// need a full neighbor list once // need a full neighbor list once
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->fix = 1; neighbor->requests[irequest]->fix = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -147,7 +147,7 @@ void ComputeSNAAtom::init()
// need an occasional full neighbor list // need an occasional full neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -141,7 +141,7 @@ void ComputeSNADAtom::init()
// need an occasional full neighbor list // need an occasional full neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -144,7 +144,7 @@ void ComputeSNAVAtom::init()
// need an occasional full neighbor list // need an occasional full neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -564,7 +564,7 @@ int FixATC::modify_param(int narg, char** arg)
void FixATC::init() void FixATC::init()
{ {
// Guarantee construction of full neighborlist // Guarantee construction of full neighborlist
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->fix = 1; neighbor->requests[irequest]->fix = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -71,7 +71,7 @@ void ComputeAcklandAtom::init()
{ {
// need an occasional full neighbor list // need an occasional full neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -69,7 +69,7 @@ void ComputeBasalAtom::init()
{ {
// need an occasional full neighbor list // need an occasional full neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -40,7 +40,7 @@ void FixPeriNeighOMP::init()
// need a full neighbor list once // need a full neighbor list once
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->fix = 1; neighbor->requests[irequest]->fix = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -80,7 +80,7 @@ void ComputeCentroAtom::init()
// need an occasional full neighbor list // need an occasional full neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -71,7 +71,7 @@ void ComputeClusterAtom::init()
// need an occasional full neighbor list // need an occasional full neighbor list
// full required so that pair of atoms on 2 procs both set their clusterID // full required so that pair of atoms on 2 procs both set their clusterID
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -92,7 +92,7 @@ void ComputeCNAAtom::init()
// need an occasional full neighbor list // need an occasional full neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -71,7 +71,7 @@ void ComputeContactAtom::init()
// need an occasional neighbor list // need an occasional neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;
neighbor->requests[irequest]->gran = 1; neighbor->requests[irequest]->gran = 1;
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;

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@ -91,7 +91,7 @@ void ComputeCoordAtom::init()
// need an occasional full neighbor list // need an occasional full neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;

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@ -150,7 +150,7 @@ void ComputeGroupGroup::init()
// need an occasional half neighbor list // need an occasional half neighbor list
if (pairflag) { if (pairflag) {
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->occasional = 1; neighbor->requests[irequest]->occasional = 1;

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@ -101,7 +101,7 @@ void ComputePairLocal::init()
// need an occasional half neighbor list // need an occasional half neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->occasional = 1; neighbor->requests[irequest]->occasional = 1;

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@ -260,7 +260,7 @@ void ComputePropertyLocal::init()
// for NEIGH/PAIR need an occasional half neighbor list // for NEIGH/PAIR need an occasional half neighbor list
if (kindflag == NEIGH || kindflag == PAIR) { if (kindflag == NEIGH || kindflag == PAIR) {
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->occasional = 1; neighbor->requests[irequest]->occasional = 1;

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@ -160,7 +160,7 @@ void ComputeRDF::init()
// need an occasional half neighbor list // need an occasional half neighbor list
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->compute = 1; neighbor->requests[irequest]->compute = 1;
neighbor->requests[irequest]->occasional = 1; neighbor->requests[irequest]->occasional = 1;

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@ -254,7 +254,7 @@ void DeleteAtoms::delete_overlap(int narg, char **arg)
// request a full neighbor list for use by this command // request a full neighbor list for use by this command
int irequest = neighbor->request((void *) this); int irequest = neighbor->request(this);
neighbor->requests[irequest]->pair = 0; neighbor->requests[irequest]->pair = 0;
neighbor->requests[irequest]->command = 1; neighbor->requests[irequest]->command = 1;
neighbor->requests[irequest]->half = 0; neighbor->requests[irequest]->half = 0;