Category:計算物理学

Monte Carlo method

Perturbation theory

First principle

Density functional theory

Interatomic potential

Molecular dynamics

Linear combination of atomic orbitals

N-body problem

Fermi–Pasta–Ulam–Tsingou problem

Periodic boundary conditions

Kohn–Sham equations

Hartree–Fock method

Computational physics

Slater determinant

Random phase approximation

Multiphysics simulation

Physical modelling synthesis

Eigenmode expansion

Madelung constant

Semi-empirical quantum chemistry method

Fragment molecular orbital

Molecular modelling

Particle mesh

Particle-in-cell