106 citations · 388 across the 10 of their papers we have counts for
12 papers
Surface Pourbaix plots of M@N4-graphene single-atom electrocatalysts from Density Functional Theory thermodynamic modelling
Ana S. Dobrota, Natalia V. Skorodumova, Slavko V. Mentus +1
Single-atom catalysts (SACs) are rapidly developing in various application areas, including electrocatalysis of different reactions, usually taking place under harsh pH-electrode p…
Electrochemical reduction of thin graphene-oxide films in aqueous solutions: restoration of conductivity
Dalibor Karačić, Sanjin J. Gutić, Borislav Vasić +4
Graphene oxide finds applications in different fields of science, including energy conversion. Electrochemical reduction of graphene oxide (GO) significantly improves its conductiv…
Reactivity screening of single atoms on modified graphene surface -- From formation and scaling relations to catalytic activity
Aleksandar Z. Jovanović, Slavko V. Mentus, Natalia V. Skorodumova +1
Single atom catalysts (SACs) present the ultimate level of catalyst utilization, which puts them in the focus of current research. For this reason, their understanding is crucial f…
Theoretical analysis of doped graphene as cathode catalyst in Li-O2 and Na-O2 batteries -- the impact of the computational scheme
Katarina A. Novčić, Ana S. Dobrota, Milena Petković +4
Understanding the reactions in M-O2 cells (M = Li or Na) is of great importance for further advancement of this promising technology. Computational modelling can be helpful along t…
Altering the reactivity of pristine, N- and P-doped graphene by strain engineering: a DFT view on energy related aspects
Ana S. Dobrota, Igor A. Pašti, Slavko V. Mentus +2
For carbon-based materials, in contrast to metal surfaces, the relationship between strain and reactivity is not yet established, even though there are literature reports on strain…
Nanocarbons derived from polymers for electrochemical energy conversion and storage - A review
Igor A. Pašti, Aleksandra Janoševic Ležaic, Nemanja M. Gavrilov +2
Energy demands of modern society require efficient means of energy conversion and storage. Nanocarbons have been identified as versatile materials which combine many desirable prop…