Non-invasive improvement of machining by reversible electrochemical doping: a proof of principle with computational modeling

TL;DR

This study demonstrates that reversible electrochemical doping with lithium can enhance the machinability of ceramics like TiO2 by reducing their work strength, without damaging their structure, based on computational modeling.

Contribution

It introduces a novel, non-invasive method of improving ceramic machinability through reversible electrochemical doping, supported by computational evidence.

Findings

Lithium intercalation lowers work material strength.

No significant change in elastic constants at room temperature.

Reversible doping preserves host structure.

Abstract

We propose that the machinability of hard ceramics can be improved by reversible electrochemical doping. On the example of TiO2, we show in a combined density functional theory-molecular dynamics computational study that a small amount of intercalated lithium, which preserves the host structure and can be introduced reversibly, leads to a lowering of the strength of work materials and the cutting force. This is in spite of the fact that there are no significant modifications of the elastic constants at room temperature, i.e. the effect is mostly on plastic properties. This approach is expected to be applicable to a class of ceramics exhibiting similar mechanisms of host-dopant interactions and presents a reversible and non-destructive way of modifying mechanical properties.