9. Forcefields

Functional forms and forcefields available in Dissolve

Overview

Dissolve comes with a number of built-in forcefields that cover a variety of common (and not so common) systems, enabling simulations to be set up quickly and easily. If your system isn’t covered by one of the built-in forcefields, get in touch with the team and we’ll see what we can do.

The following sections detail the various interaction potential forms available within Dissolve, and give implementation details of specific forcefields.


Built-In Forcefields

Forcefields built-in to Dissolve

Functional Forms

Functional forms

NETA

The Nested English Typing Approach (NETA)

Last modified November 20, 2024: Updating Developer Docs (#1545) (19274c2)