Unverified Commit 7547e1da authored by Axel Kohlmeyer's avatar Axel Kohlmeyer
Browse files

make certain that the vector storage and the size_vector variable are consistent in computes

parent 5e3a7059

src/ASPHERE/compute_temp_asphere.cpp

+1 −1
Original line number Diff line number Diff line
@@ -78,7 +78,7 @@ ComputeTempAsphere::ComputeTempAsphere(LAMMPS *lmp, int narg, char **arg) : 


  if (mode == ROTATE) extra_dof = 0;



  vector = new double[6];

  vector = new double[size_vector];



}

src/BODY/compute_temp_body.cpp

+1 −1
Original line number Diff line number Diff line
@@ -71,7 +71,7 @@ ComputeTempBody::ComputeTempBody(LAMMPS *lmp, int narg, char **arg) : 
    } else error->all(FLERR,"Illegal compute temp/body command");

  }



  vector = new double[6];

  vector = new double[size_vector];



}

src/CORESHELL/compute_temp_cs.cpp

+1 −1
Original line number Diff line number Diff line
@@ -101,7 +101,7 @@ ComputeTempCS::ComputeTempCS(LAMMPS *lmp, int narg, char **arg) : 


  // allocate memory



  vector = new double[6];

  vector = new double[size_vector];

  maxatom = 0;

  vint = NULL;

src/SPIN/compute_spin.cpp

+1 −1
Original line number Diff line number Diff line
@@ -149,6 +149,6 @@ void ComputeSpin::compute_vector() 


void ComputeSpin::allocate()

{

  memory->create(vector,6,"compute/spin:vector");

  memory->create(vector,size_vector,"compute/spin:vector");

}

src/USER-BOCS/compute_pressure_bocs.cpp

+3 −3
Original line number Diff line number Diff line
@@ -108,7 +108,7 @@ ComputePressureBocs::ComputePressureBocs(LAMMPS *lmp, int narg, char **arg) : 
    error->all(FLERR,"Compute pressure/bocs requires temperature ID "

               "to include kinetic energy");



  vector = new double[6];

  vector = new double[size_vector];

  nvirial = 0;

  vptr = NULL;

}

CRA Git | Maintained and supported by SUSTech CRA and CCSE