Jithin John Varghese, "The role of the metal core in the WOx inverse catalyst performance", Chem Catalysis, 3, 100780, 2023 (Invited preview article, link) 

Tamilmani Selvaraj, Preeti Aghalayam* and Jithin John Varghese*, “The Influence of oxygen vacancy and dopant in NiO catalysts on the selective catalytic reduction of NO with NH3”, Journal of Physical Chemistry C, 127, 19468-19477, 2023 (link)

Anoop P. Pushkar and Jithin John Varghese*, Surface reactivity of VOx/CeO2 (111) and the impact of transition metal doping of CeO2 support on oxidative dehydrogenation of propane", Journal of Catalysis, 425, 372-385, 2023 (link)

Ajin Rajan, Anoop P. Pushkar, Balaji C. Dharmalingam and Jithin John Varghese*, "Iterative multiscale and multi-physics computations for operando catalyst nanostructure elucidation and kinetic modeling", iScience, 26, 107029, 2023 (link)

Ajin Rajan and Jithin John Varghese*, Towards selective glycerol hydrodeoxygenation to 1,3-propanediol with effective Pt-WOx catalyst design: Insights from first principles" Journal of Catalysis, 423, 94-104, 2023 (link)

B. Sathya Sai Rengam, Pushkala Venkatesh and Jithin John Varghese*, Impact of solvent sulfolane in enhancing methanol selectivity during methane partial oxidation on Fe-ZSM5 catalyst with H2O2 as an oxidant", Reaction Chemistry and Engineering, 8, 1260-1269,  2023 (Featured on Back Cover of the journal)

Balaji C. Dharmalingam, Ajay Koushik V, Mauro Mureddu, Luciano Atzori, Sarah Lai,
Alberto Pettinau, Niket S. Kaisare*, Preeti Aghalayam*, Jithin John Varghese*, Unravelling the role of metal-metal oxide interfaces of Cu/ZnO/ZrO2/Al2O3 catalyst for methanol synthesis from CO2: Insights from experiments and DFT-based microkinetic modeling", Applied Catalysis B, 332, 122743, 2023 (link)

Anoop P Pushkar and Jithin J. Varghese*, "Impact of surface-active site heterogeneity and surface hydroxylation in Ni doped ceria catalysts on oxidative dehydrogenation of propane", Journal of Catalysis, 413, 681-691, 2022  (link)

Jayashree Ethiraj*, R. Ajin, R.K. Sankaranarayanan, Ranjith Sekar*, Dhinakaran Veeman, Moola Joghee Nanjan and Jithin J. Varghese*, Crystallographic and computational investigations of structural properties in phenyl and methoxy‑phenyl substituted 1,4 dihydropyridine derivatives, Journal of Molecular Structure, 1254, 132378, 2022. (link)

Nicholas A. Jose, Jithin J. Varghese, Samir H. Mushrif, Hua Chun Zeng, & Alexei A. Lapkin, "Two-Dimensional Metal Organic Framework Superstructures via Solvent-Mediated Oriented Attachment", The Journal of Physical Chemistry C, 125, 22837–22847, 2021 (link)

Rimita Bose, Jayashree Ethiraj, Palla Sridhar, Jithin J. Varghese, Niket S. Kaisare & Parasuraman Selvam, "Adsorption of hydrogen and carbon dioxide in zeolitic imidazolate framework structure with SOD topology: experimental and modelling studies", Adsorption, 26, 1027-1038, 2020. (link)

Jithin J. Varghese*, "Computational design of catalysts for biowaste upgrading", Current Opinion in Chemical Engineering, 26, 20-27, 2019. (link)

Jithin J. Varghese, Liwei Cao, Christopher Robertson, Yanhui Yang, Alexei Lapkin, Lynn F Gladden and Samir H. Mushrif, “Synergistic contribution of acidic metal oxide and metal towards the selective hydrogenolysis of glycerol: a combined experimental and computational study using ReOx-Ir as the catalyst”, ACS Catalysis, 9, 485–503, 2019. (link)

Jithin J. Varghese*, Samir H. Mushrif, “Origins of complex solvent effects on chemical reactivity and computational tools to investigate them: a review”, Reaction Chemistry and Engineering, 4, 165 - 206, 2019, (link) (RCE Emerging Investigators 2019  Themed Issue). Featured in Front Cover of Journal

Jithin J. Varghese, Bharathi Saravanan, Holger Vach, Gilles H. Peslherbe, Samir H. Mushrif, “First-principles investigation of the coupling-induced dissociation of methane and its transformation to ethane and ethylene, Chemical Physics Letters, 708, 21-27, 2018. (link)

Prince N. Amaniampong, Quang Thang Trinh, Jithin J. Varghese, Ronan Behling, Sabine Valange, Samir H. Mushrif and Francois Jerome, “Unraveling the mechanism of the oxidation of glycerol to dicarboxylic acids over a sonochemically synthesized copper oxide catalyst”, Green Chemistry, 20, 2730-2741, 2018. (link) Featured in Back Cover of Journal 

Kartavya Bhola, Jithin J. Varghese, Liu Dapeng, Liu Yan and Samir H. Mushrif, “The influence of Hubbard U parameter in simulating adsorption and reactivity on CuO: a combined theoretical and experimental study”, The Journal of Physical Chemistry C, 121, 21343–21353, 2017 (link)

Jithin J. Varghese and Samir H. Mushrif, “Insights into the C-H Bond activation on NiO surfaces: the role of nickel and oxygen vacancies and of low valent dopants on the reactivity and energetics”, The Journal of Physical Chemistry C, 121, 17969-17981, 2017 (link)

Jithin J. Varghese, Q. T. Trinh and Samir H. Mushrif, “Insights into the synergistic role of metal-lattice oxygen site pairs in four-centred C-H bond activation of methane: the case of CuO”, Catalysis Science and Technology, 6, 3984 – 3996, 2016 (link)

Jithin J. Varghese and Samir H. Mushrif, “First principles investigation of the dissociation and coupling of methane on small copper clusters: interplay of collision dynamics and geometric and electronic effects”, The Journal of Chemical Physics, 142, 184308, 2015 (link)

Samir H. Mushrif, Jithin J. Varghese, Chethan B.K., “Solvation dynamics and energetics of intramolecular hydride transfer reactions in biomass conversion”, Physical Chemistry Chemical Physics, 17, 4961-4969, 2015 (link)

Samir H. Mushrif, Jithin J. Varghese, Dion G. Vlachos, “Insights into the Cr(III) catalyzed isomerization mechanism of glucose to fructose in the presence of water using ab initio molecular dynamics”, Physical Chemistry Chemical Physics, 16, 19564-19572, 2014 (link)