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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9108 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2012-11-26 18:29:31 +00:00
parent eb7c94ccef
commit a64357160f
2 changed files with 131 additions and 32 deletions
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src/compute_temp_profile.h
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@ -31,6 +31,7 @@ class ComputeTempProfile : public Compute {
void init();
double compute_scalar();
void compute_vector();
void compute_array();
void remove_bias(int, double *);
void remove_bias_all();
@ -39,7 +40,7 @@ class ComputeTempProfile : public Compute {
double memory_usage();
private:
int xflag,yflag,zflag,ncount;
int xflag,yflag,zflag,ncount,outflag;
int nbinx,nbiny,nbinz,nbins;
int ivx,ivy,ivz;
int fix_dof;
@ -53,6 +54,7 @@ class ComputeTempProfile : public Compute {
int maxatom;
int *bin;
double **vbin,**binave;
double *tbin,*tbinall;
void dof_compute();
void bin_average();