Changeset e83114 for src/Potentials/PotentialFactory.hpp

Timestamp:

Aug 30, 2025, 2:41:40 PM (8 weeks ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

Candidate_v1.7.0, stable

Children:

a0d8aa

Parents:

72b6d7

git-author:

Frederik Heber <frederik.heber@…> (08/16/25 10:32:39)

git-committer:

Frederik Heber <frederik.heber@…> (08/30/25 14:41:40)

Message:

StreamFactory_EmpiricalPotential creates potential instances with params.

• EmpiricalPotential expose getter and setter for parameters.
• potential and stream factor for EmpiricalPotential have new createInstance that also takes a present parameter set.
• this is used in StreamFactory_EmpiricalPotential::createInstance from istream to create the correct instance with parameters directly.

File:

• src/Potentials/PotentialFactory.hpp (modified) (1 diff)

src/Potentials/PotentialFactory.hpp

@@ -59 +59 @@
       const SerializablePotential::ParticleTypes_t &charges) const;
 
+  /** Creates an instance of the requested potential.
+   *
+   * \param potentialtype key of potential to create
+   * \param charges charges for which the potential is (to be) fitted
+   */
+  EmpiricalPotential *createInstance(
+      const std::string &potentialtype,
+      const SerializablePotential::ParticleTypes_t &charges,
+                        const FunctionModel::parameters_t &params) const;
+
   //!> typedef for map to lookup type for a given name
   typedef std::map< std::string, enum PotentialTypes > NameToType_t;