Changes in src/atom.hpp [ad2b411:9df5c6]

File:

• src/atom.hpp (modified) (2 diffs)

src/atom.hpp

@@ -51 +51 @@
 
   bool OutputIndexed(ofstream * const out, const int ElementNo, const int AtomNo, const char *comment = NULL) const;
-  bool OutputArrayIndexed(ofstream * const out, const int *ElementNo, int *AtomNo, const char *comment = NULL) const;
+  bool OutputArrayIndexed(ostream * const out, const int *ElementNo, int *AtomNo, const char *comment = NULL) const;
   bool OutputXYZLine(ofstream *out) const;
   bool OutputTrajectory(ofstream * const out, const int *ElementNo, int *AtomNo, const int step) const;
   bool OutputTrajectoryXYZ(ofstream * const out, const int step) const;
-  void OutputMPQCLine(ofstream * const out, const Vector *center, int *AtomNo) const;
+  void OutputMPQCLine(ostream * const out, const Vector *center, int *AtomNo) const;
 
   void InitComponentNr();
@@ -66 +66 @@
   double DistanceToVector(const Vector &origin) const;
   double DistanceSquaredToVector(const Vector &origin) const;
-  bool IsInParallelepiped(const Vector offset, const double *parallelepiped) const;
+  bool IsInParallelepiped(const Vector offset, const Matrix &parallelepiped) const;
 
   // getter and setter