Unverified Commit a80c80c7 authored by Richard Berger's avatar Richard Berger
Browse files

Add type information for table potentials

parent d6e062d0

src/MOLECULE/angle_table.cpp

+1 −1
Original line number Diff line number Diff line
@@ -383,7 +383,7 @@ void AngleTable::free_table(Table *tb) 


void AngleTable::read_table(Table *tb, char *file, char *keyword)

{

  TableFileReader reader(lmp, file);

  TableFileReader reader(lmp, file, "angle");



  char * line = reader.find_section_start(keyword);

src/MOLECULE/bond_table.cpp

+1 −1
Original line number Diff line number Diff line
@@ -309,7 +309,7 @@ void BondTable::free_table(Table *tb) 


void BondTable::read_table(Table *tb, char *file, char *keyword)

{

  TableFileReader reader(lmp, file);

  TableFileReader reader(lmp, file, "bond");

  double emin = BIGNUM;



  char * line = reader.find_section_start(keyword);

src/table_file_reader.cpp

+3 −2
Original line number Diff line number Diff line
@@ -27,8 +27,9 @@ 
using namespace LAMMPS_NS;



TableFileReader::TableFileReader(LAMMPS *lmp,

                                         const std::string &filename) : 

  PotentialFileReader(lmp, filename, "table")

                                         const std::string &filename,

                                         const std::string &type) : 

  PotentialFileReader(lmp, filename, type + " table")

{

}

src/table_file_reader.h

+1 −1
Original line number Diff line number Diff line
@@ -24,7 +24,7 @@ namespace LAMMPS_NS 
{

  class TableFileReader : public PotentialFileReader {

  public:

    TableFileReader(class LAMMPS *lmp, const std::string &filename);

    TableFileReader(class LAMMPS *lmp, const std::string &filename, const std::string & type);

    virtual ~TableFileReader();



    char * find_section_start(const std::string & keyword);

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