Abstract
Recent advances in open source software capabilities, concurrent with advances in computational chemistry and operando diagnostics, provide new opportunities for modeling complex electrochemical phenomena. These capabilities include (i) new tools for modeling electrochemical processes; (ii) software for efficient and powerful numerical simulation, analysis, and visualization; (iii) and software ecosystem tools to enable efficient management and development of new computational tools. Herein, we highlight some of the open source software tools relevant to electrochemical simulations and demonstrate these capabilities within the context of modeling the growth of the solid electrolyte interphase in lithium ion batteries. Finally, we discuss the future outlook for open source software tools within the context of data science and electrochemistry research.
Sign-in/Register to access full text options 
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a call
