ESPResSo
Extensible Simulation Package for Research on Soft Matter Systems
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Files | |
bmhtf-nacl.cpp | |
Implementation of bmhtf-nacl.hpp. | |
bmhtf-nacl.hpp | |
Routines to calculate the Born-Meyer-Huggins-Tosi-Fumi potential between particle pairs. | |
buckingham.cpp | |
Implementation of buckingham.hpp. | |
buckingham.hpp | |
Routines to calculate the Buckingham potential between particle pairs. | |
gaussian.cpp | |
Implementation of gaussian.hpp. | |
gaussian.hpp | |
Routines to calculate the Gaussian potential between particle pairs. | |
gay_berne.cpp | |
Implementation of gay_berne.hpp. | |
gay_berne.hpp | |
Routines to calculate the Gay-Berne potential between particle pairs. | |
hat.cpp | |
Implementation of hat.hpp. | |
hat.hpp | |
Routines to calculate the hat potential between particle pairs. | |
hertzian.cpp | |
Implementation of hertzian.hpp. | |
hertzian.hpp | |
Routines to calculate the Hertzian potential between particle pairs. | |
lj.cpp | |
Implementation of lj.hpp. | |
lj.hpp | |
Routines to calculate the Lennard-Jones potential between particle pairs. | |
ljcos.cpp | |
Implementation of ljcos.hpp. | |
ljcos.hpp | |
Routines to calculate the Lennard-Jones+cosine potential between particle pairs. | |
ljcos2.cpp | |
Implementation of ljcos2.hpp. | |
ljcos2.hpp | |
Routines to calculate the Lennard-Jones with cosine tail potential between particle pairs. | |
ljgen.cpp | |
Implementation of ljgen.hpp. | |
ljgen.hpp | |
Routines to calculate the generalized Lennard-Jones potential between particle pairs. | |
morse.cpp | |
Implementation of morse.hpp. | |
morse.hpp | |
Routines to calculate the Morse potential between particle pairs. | |
nonbonded_interaction_data.cpp | |
Implementation of nonbonded_interaction_data.hpp. | |
nonbonded_interaction_data.hpp | |
Various procedures concerning interactions between particles. | |
nonbonded_tab.hpp | |
Routines to calculate the energy and/or force for particle pairs via interpolation of lookup tables. | |
smooth_step.cpp | |
Implementation of smooth_step.hpp. | |
smooth_step.hpp | |
Routines to calculate the smooth step potential between particle pairs. | |
soft_sphere.cpp | |
Implementation of soft_sphere.hpp. | |
soft_sphere.hpp | |
Routines to calculate the soft-sphere potential between particle pairs. | |
thole.hpp | |
Routines to calculate the Thole damping potential between particle pairs. | |
VerletCriterion.hpp | |
wca.cpp | |
Implementation of wca.hpp. | |
wca.hpp | |
Routines to calculate the Weeks-Chandler-Andersen potential between particle pairs. | |