Note: When clicking on a Digital Object Identifier (DOI) number, you will be taken to an external site maintained by the publisher.
                                            Some full text articles may not yet be available without a charge during the embargo (administrative interval).
                                        
                                        
                                        
                                            
                                                
                                             What is a DOI Number?
                                        
                                    
                                
Some links on this page may take you to non-federal websites. Their policies may differ from this site.
- 
            Free, publicly-accessible full text available July 1, 2026
- 
            Free, publicly-accessible full text available May 1, 2026
- 
            Free, publicly-accessible full text available May 1, 2026
- 
            Free, publicly-accessible full text available April 30, 2026
- 
            Free, publicly-accessible full text available June 3, 2026
- 
            Free, publicly-accessible full text available June 3, 2026
- 
            In this paper, we provide a detailed theoretical analysis of the numerical scheme introduced in [C. Liu, C. Wang, and Y. Wang, J. Comput. Phys., 436:110253, 2021] for the reaction kinetics of a class of chemical reaction networks that satisfies detailed balance condition. In contrast to conventional numerical approximations, which are typically constructed based on ordinary differential equations (ODEs) for the concentrations of all involved species, the scheme is developed using the equations of reaction trajectories, which can be viewed as a generalized gradient flow of a physically relevant free energy. The unique solvability, positivity-preserving, and energy-stable properties are proved for the general case involving multiple reactions, under a mild condition on the stoichiometric matrix.more » « lessFree, publicly-accessible full text available January 1, 2026
- 
            Free, publicly-accessible full text available February 28, 2026
- 
            Free, publicly-accessible full text available December 1, 2025
- 
            A finite difference numerical scheme is proposed and analyzed for the Cahn-Hilliard-Stokes system with Flory-Huggins energy functional. A convex splitting is applied to the chemical potential, which in turns leads to the implicit treatment for the singular logarithmic terms and the surface diffusion term, and an explicit update for the expansive concave term. The convective term for the phase variable, as well as the coupled term in the Stokes equation, is approximated in a semi-implicit manner. In the spatial discretization, the marker and cell difference method is applied, which evaluates the velocity components, the pressure and the phase variable at different cell locations. Such an approach ensures the divergence-free feature of the discrete velocity, and this property plays an important role in the analysis. The positivity-preserving property and the unique solvability of the proposed numerical scheme are theoretically justified, utilizing the singular nature of the logarithmic term as the phase variable approaches the singular limit values. An unconditional energy stability analysis is standard, as an outcome of the convex-concave decomposition technique. A convergence analysis with accompanying error estimate is provided for the proposed numerical scheme. In particular, a higher order consistency analysis, accomplished by supplementary functions, is performed to ensure the separation properties of numerical solution. In turn, using the approach of rough and refined error estimates, we are able to derive an optimal rate convergence. To conclude, several numerical experiments are presented to validate the theoretical analysis.more » « less
 An official website of the United States government
An official website of the United States government 
				
			 
					 
					
