ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

apply clang-tidy updates

Browse Source
This commit is contained in:
Axel Kohlmeyer
2022-04-10 11:31:49 -04:00
parent 1a2d83ab01
commit 413a01ade5
42 changed files with 106 additions and 106 deletions
Download Patch File Download Diff File Expand all files Collapse all files

16
lib/atc/LammpsInterface.cpp
View File

@ -483,7 +483,7 @@ void LammpsInterface::periodicity_correction(double * x) const
}
}
void LammpsInterface::set_reference_box(void) const
void LammpsInterface::set_reference_box() const
{
double * hi = lammps_->domain->boxhi;
double * lo = lammps_->domain->boxlo;
@ -570,7 +570,7 @@ void LammpsInterface::closest_image(const double * const xi, const double * cons
// -----------------------------------------------------------------
// update interface methods
// -----------------------------------------------------------------
LammpsInterface::UnitsType LammpsInterface::units_style(void) const
LammpsInterface::UnitsType LammpsInterface::units_style() const
{
if (strcmp(lammps_->update->unit_style,"lj") == 0) return LJ;
else if (strcmp(lammps_->update->unit_style,"real") == 0) return REAL;
@ -655,7 +655,7 @@ void LammpsInterface::basis_vectors(double **basis) const
}
//* gets the (max) lattice constant
double LammpsInterface::max_lattice_constant(void) const
double LammpsInterface::max_lattice_constant() const
{
double a1[3], a2[3], a3[3];
unit_cell(a1,a2,a3);
@ -666,7 +666,7 @@ double LammpsInterface::max_lattice_constant(void) const
}
//* computes a cutoff distance halfway between 1st and 2nd nearest neighbors
double LammpsInterface::near_neighbor_cutoff(void) const
double LammpsInterface::near_neighbor_cutoff() const
{
double cutoff;
double alat = LammpsInterface::max_lattice_constant();
@ -716,7 +716,7 @@ void LammpsInterface::unit_cell(double *a1, double *a2, double *a3) const
}
//* gets number of atoms in a unit cell
int LammpsInterface::num_atoms_per_cell(void) const
int LammpsInterface::num_atoms_per_cell() const
{
int naCell = 0;
LatticeType type = lattice_style();
@ -733,7 +733,7 @@ int LammpsInterface::num_atoms_per_cell(void) const
}
//* gets tributary volume for an atom
double LammpsInterface::volume_per_atom(void) const
double LammpsInterface::volume_per_atom() const
{
double naCell = num_atoms_per_cell();
double volPerAtom =
@ -1468,7 +1468,7 @@ LAMMPS_NS::Compute * LammpsInterface::const_to_active(COMPUTE_POINTER computePoi
// compute pe/atom interface methods
// - the only compute "owned" by ATC
// -----------------------------------------------------------------
int LammpsInterface::create_compute_pe_peratom(void) const
int LammpsInterface::create_compute_pe_peratom() const
{
char **list = new char*[4];
string atomPeName = compute_pe_name();
@ -1493,7 +1493,7 @@ int LammpsInterface::create_compute_pe_peratom(void) const
return icompute;
}
double * LammpsInterface::compute_pe_peratom(void) const
double * LammpsInterface::compute_pe_peratom() const
{
if (atomPE_) {
atomPE_->compute_peratom();