From bbc025632da8622e59c9f00527ab364c681b2c09 Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Tue, 22 Apr 2025 10:50:24 -0400 Subject: [PATCH] apply clang-format --- src/EXTRA-PAIR/pair_lj_pirani.cpp | 3 +- src/EXTRA-PAIR/pair_lj_pirani.h | 66 +++++++++++++++---------------- 2 files changed, 34 insertions(+), 35 deletions(-) diff --git a/src/EXTRA-PAIR/pair_lj_pirani.cpp b/src/EXTRA-PAIR/pair_lj_pirani.cpp index 6c6dbe1c1c..259355ecd9 100644 --- a/src/EXTRA-PAIR/pair_lj_pirani.cpp +++ b/src/EXTRA-PAIR/pair_lj_pirani.cpp @@ -532,7 +532,6 @@ void PairLJPirani::compute_outer(int eflag, int vflag) if (eflag) { - r = sqrt(rsq); rx = r / rm[itype][jtype]; @@ -841,7 +840,7 @@ void PairLJPirani::write_data_all(FILE *fp) /* ---------------------------------------------------------------------- */ double PairLJPirani::single(int /*i*/, int /*j*/, int itype, int jtype, double rsq, - double /*factor_coul*/, double factor_lj, double &fforce) + double /*factor_coul*/, double factor_lj, double &fforce) { double r, rx, n_x, filj1, filj2, filj3, filj4, filj5, filj6, forceilj; double ilj1, ilj2; diff --git a/src/EXTRA-PAIR/pair_lj_pirani.h b/src/EXTRA-PAIR/pair_lj_pirani.h index 83798e4e01..0fa3a16fe9 100644 --- a/src/EXTRA-PAIR/pair_lj_pirani.h +++ b/src/EXTRA-PAIR/pair_lj_pirani.h @@ -17,44 +17,44 @@ PairStyle(lj/pirani,PairLJPirani); // clang-format on #else -#ifndef LMP_PAIR_LJ_PIRANI -#define LMP_PAIR_LJ_PIRANI +#ifndef LMP_PAIR_LJ_PIRANI_H +#define LMP_PAIR_LJ_PIRANI_H #include "pair.h" namespace LAMMPS_NS { - class PairLJPirani : public Pair { - public: - PairLJPirani(class LAMMPS *); - virtual ~PairLJPirani() override; - void compute(int, int) override; - void settings(int, char **) override; - void coeff(int, char **) override; - void init_style() override; - double init_one(int, int) override; - void write_restart(FILE *) override; - void read_restart(FILE *) override; - void write_restart_settings(FILE *) override; - void read_restart_settings(FILE *) override; - void write_data(FILE *) override; - void write_data_all(FILE *) override; - double single(int, int, int, int, double, double, double, double &) override; - void *extract(const char *, int &) override; - void compute_inner() override; - void compute_middle() override; - void compute_outer(int, int) override; +class PairLJPirani : public Pair { + public: + PairLJPirani(class LAMMPS *); + virtual ~PairLJPirani() override; + void compute(int, int) override; + void settings(int, char **) override; + void coeff(int, char **) override; + void init_style() override; + double init_one(int, int) override; + void write_restart(FILE *) override; + void read_restart(FILE *) override; + void write_restart_settings(FILE *) override; + void read_restart_settings(FILE *) override; + void write_data(FILE *) override; + void write_data_all(FILE *) override; + double single(int, int, int, int, double, double, double, double &) override; + void *extract(const char *, int &) override; + void compute_inner() override; + void compute_middle() override; + void compute_outer(int, int) override; - protected: - double cut_global; - double **cut; - double **alpha,**beta,**gamma,**rm,**epsilon; - double **offset; - double *cut_respa; - virtual void allocate(); - }; + protected: + double cut_global; + double **cut; + double **alpha, **beta, **gamma, **rm, **epsilon; + double **offset; + double *cut_respa; + virtual void allocate(); +}; - } // namespace LAMMPS_NS +} // namespace LAMMPS_NS - #endif - #endif +#endif +#endif