期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 265 ()
We have developed a Mathematica program package SpaceGroupirep which is a database and tool set for irreducible representations (IRs) of space group i......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 269 ()
A new method based on a time diffusion technique is developed to mitigate the numerical instability induced by the high frequency electrostatic shear ......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 263 ()
In this paper we present a high-accuracy charge conservation scheme of current assignment for particle-in-cell (PIC) simulations in two dimensional sp......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 269 ()
Interatomic potential (i.e. force-field) plays a vital role in atomistic simulation of materials. Empirical potentials like the embedded atom method (......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 269 ()
The simulation of beam energy transfer and medium dynamics is essential in nuclear studies and designs involving the beam loading on targets. Although......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 264 ()
Triply periodic minimal surfaces (TPMSs), which are periodic in all three directions and are surfaces of zero mean curvature, have been proven experim......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 267 ()
In this paper, we present an open-source multi-resolution and multi-physics library, SPHinXsys, which is released under the Apache License (2.0). Alon......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 267 ()
In this paper, exponential propagator (EP) is introduced to the discontinuous Galerkin finite element method (DG-FEM) for solving transient electromag......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 263 ()
The finite-time dynamical method is an effective tool studying phase transition in many-body systems. We design a parallel version of this method base......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 263 ()
In this paper, a Petrov-Galerkin finite element interface method (PGFEIM) is proposed to compute the band structures of 2D photonic crystals (PtCs) wi......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 264 ()
In this work, we present the program MAELAS to calculate magnetocrystalline anisotropy energy, anisotropic magnetostrictive coefficients and magnetoel......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 267 ()
We present the VASPKIT, a command-line program that aims at providing a robust and user-friendly interface to perform high-throughput analysis of a va......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 267 ()
By developing a multilevel thermosolutal phase-field lattice-Boltzmann method, we achieve three-dimensional phase-field simulations of dendrite growth......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 266 ()
Characterization of structural information at the atomistic level in molecular dynamics (MD) simulations is a necessary task for researchers in the fi......
期刊： COMPUTER PHYSICS COMMUNICATIONS, 2021; 265 ()
The Cluster-Cluster Aggregation model (CCA) was often used to simulate the aggregation of colloids, in which the rapid and slow aggregation processes ......
