Published August 1993
| Version v1
Journal article
On the fast multipole method for computing the energy of periodic assemblies of charged and dipolar particles
Description
In two dimensions, it is convenient to represent the coordinates (x, y) of particles as complex numbers z = x + iy. The energy of interaction of two point charges q1 and q 2 at points represented by the complex numbers z1 and z2 is then since the natural logarithm is the singular part of the Greens function for the two-dimensional Laplace equation. In performing molecular dynamics and Monte Carlo simulations of neutral systems of charged particles or of point dipoles, it is necessary to compute the energies and forces of an infinite periodic system in which the N charges or dipoles at the points z1 ... zn resident in the primary (usually square) simulation cell are replicated everywhere in the plane
Additional details
Publishing Information
- Journal Title
- Journal of Computational Physics
- Journal Volume
- 107
- Journal Issue
- 2
- Journal Page Range
- p. 403-405.
- ISSN
- 0021-9991
- CODEN
- JCTPAH
INIS
- Country of Publication
- United States
- Country of Input or Organization
- United States
- INIS RN
- 25029454
- Subject category
- S71: CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS; S99: GENERAL AND MISCELLANEOUS;
- Descriptors DEI
- CHARGED PARTICLES; COMPUTERIZED SIMULATION; GREEN FUNCTION; ITERATIVE METHODS; LAPLACE EQUATION; MONTE CARLO METHOD; NUMERICAL SOLUTION
- Descriptors DEC
- CALCULATION METHODS; DIFFERENTIAL EQUATIONS; EQUATIONS; FUNCTIONS; PARTIAL DIFFERENTIAL EQUATIONS; SIMULATION