Statements (23)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
interatomic potential
|
| gptkbp:alternativeName |
12-6 potential
|
| gptkbp:application |
liquids and solids
modeling noble gases modeling van der Waals forces |
| gptkbp:category |
pair potential
empirical potential |
| gptkbp:describes |
interaction between a pair of neutral atoms or molecules
|
| gptkbp:feature |
long-range attraction
short-range repulsion |
| gptkbp:form |
V(r) = 4ε[(σ/r)^12 - (σ/r)^6]
|
| gptkbp:formedBy |
gptkb:John_Lennard-Jones
1924 |
| gptkbp:fullName |
gptkb:Lennard-Jones_potential
|
| https://www.w3.org/2000/01/rdf-schema#label |
LJ potential
|
| gptkbp:influenced |
development of other interatomic potentials
|
| gptkbp:parameter |
σ (finite distance at which the inter-particle potential is zero)
ε (depth of the potential well) |
| gptkbp:usedIn |
gptkb:statistical_mechanics
computational chemistry molecular dynamics simulations |
| gptkbp:bfsParent |
gptkb:Lennard-Jones_potential
|
| gptkbp:bfsLayer |
6
|