add extract() function to bond_gaussian.h

2024-10-11 10:54:24 +02:00
parent 732ef6bd44
commit 7da8434d5b
1 changed files with 1 additions and 0 deletions
--- a/src/EXTRA-MOLECULE/bond_gaussian.h
+++ b/src/EXTRA-MOLECULE/bond_gaussian.h
@ -36,6 +36,7 @@ class BondGaussian : public Bond {
  void write_data(FILE *) override;
  double single(int, double, int, int, double &) override;
  void born_matrix(int, double, int, int, double &, double &) override;
+  void *extract(const char *, int &) override;

 protected:
  int *nterms;