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Change necessary for pair_exp6_rx_kokkos to compile on GPU

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Stan Moore
2016-12-19 17:15:02 -07:00
parent f62a6fe5a5
commit 889ee78f8b
1 changed files with 8 additions and 7 deletions
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15
src/USER-DPD/pair_exp6_rx.h
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@ -37,6 +37,14 @@ class PairExp6rx : public Pair {
void write_restart_settings(FILE *); void write_restart_settings(FILE *);
void read_restart_settings(FILE *); void read_restart_settings(FILE *);
struct Param {
double epsilon,rm,alpha;
int ispecies;
char *name, *potential; // names of unique molecules and interaction type
char *tablename; // name of interaction table
int potentialType; // enumerated interaction potential type.
};
protected: protected:
enum{LINEAR}; enum{LINEAR};
double cut_global; double cut_global;
@ -48,13 +56,6 @@ class PairExp6rx : public Pair {
int *mol2param; // mapping from molecule to parameters int *mol2param; // mapping from molecule to parameters
int nparams; // # of stored parameter sets int nparams; // # of stored parameter sets
int maxparam; // max # of parameter sets int maxparam; // max # of parameter sets
struct Param {
double epsilon,rm,alpha;
int ispecies;
char *name, *potential; // names of unique molecules and interaction type
char *tablename; // name of interaction table
int potentialType; // enumerated interaction potential type.
};
Param *params; // parameter set for an I-J-K interaction Param *params; // parameter set for an I-J-K interaction
int nspecies; int nspecies;