引用次数
引用: 449
H-指数: 10
I10-指数 : 10
出版物: 38
Surface stability of perovskite oxides under OER operating conditions: a first principles approach.
Abhinav S Raman , Roshan Patel , Aleksandra Vojvodic
Faraday Discussions 229 75 -88
16
2021
Providing atomistic insights into the dissolution of rutile oxides in electrocatalytic water splitting
Abhinav S Raman , Aleksandra Vojvodic
The Journal of Physical Chemistry C 126 ( 2) 922 -932
6
2022
Electrical double layer and capacitance of TiO2 electrolyte interfaces from first principles simulations
Chunyi Zhang , Marcos Calegari Andrade , Zachary K Goldsmith , Abhinav S Raman
arXiv preprint arXiv:2404.00167
2024
Acid–base chemistry of a model iro2 catalytic interface
Abhinav S Raman , Annabella Selloni
The Journal of Physical Chemistry Letters 14 ( 35) 7787 -7794
5
2023
Modeling the solvation and acidity of carboxylic acids using an ab initio deep neural network potential
Abhinav S Raman , Annabella Selloni
The Journal of Physical Chemistry A 126 ( 40) 7283 -7290
4
2022
An ab-initio deep neural network potential for accurate large-scale simulations of the muscovite mica-water interface
Abhinav S Raman , Annabella Selloni
Molecular Physics e2365430 -e2365430
2024
Energy trends in adsorption at surfaces
Abhinav S Raman , Aleksandra Vojvodic
Handbook of Materials Modeling: Applications: Current and Emerging Materials 1321 -1341
3
2020
Chemisorption model for atoms and molecules on doped semiconducting oxides
Abhinav S Raman , Colin Lehman-Chong , Aleksandra Vojvodic
1
2023
Adsorption model for atoms and molecules on doped semiconducting oxides
Abhinav S Raman , Colin Lehman-Chong , Aleksandra Vojvodic
Physical Review B 109 ( 19) 195416 -195416
2024
Computational Design of Sub-Surface Engineered Metal Oxides for Catalysis
Liang Zhang , Abhinav S Raman , Aleksandra Vojvodic
2019 North American Catalysis Society Meeting
2019
Long timescale molecular dynamics simulations of carboxylic acid-modified anatase TiO2 (101)-water interfaces using ab-initio deep neural network potentials
Abhinav S Raman , Annabella Selloni
Surface Science 750 122595 -122595
1
2024
Molecular-scale insights into the electrical double layer at oxide-electrolyte interfaces
Chunyi Zhang , Marcos F Calegari Andrade , Zachary K Goldsmith , Abhinav S Raman
Nature Communications 15 ( 1) 10270 -10270
1
2024
Insights into the structure and dynamics of K+ ions at the muscovite–water interface from machine learning potential simulations
Abhinav S Raman , Annabella Selloni
The Journal of Chemical Physics 160 ( 24)
1
2024
Are formic and acetic acid covered TiO2 surfaces hydrophobic?
Abhinav S Raman , Annabella Selloni
2024
Unravelling CO Oxidation on Copper Cluster by Deep Potential Metadynamics
Haritha Lakshmanan , Jiayan Xu , Abhinav S Raman , Roberto Car
2024
Understanding and Controlling the Surface Physics and Chemistry of Complex Oxides
Abhinav S Raman
2023 AIChE Annual Meeting
2023
Facet-Dependent Segregation of Pt in ATiO 3 (A= Ca, Sr, Ba) Perovskites: Insights into the Exsolution Process
Abhinav S Raman , Aleksandra Vojvodic
2019 North American Catalysis Society Meeting
2019
Supplementary Material for: Insights into the structure and dynamics of K ions at the muscovite-water interface from machine learning potential simulations
Abhinav S Raman , Annabella Selloni
Proton Transfer and Acidity at the IrO 2-Water Interface from Deep Potential Molecular Dynamics Simulations
Abhinav Sankara Raman , Annabella Selloni
2023 AIChE Annual Meeting
2023
Trends in Adsorption of Electro-Catalytic Water Splitting Intermediates on Hetero-Structures of Perovskite Oxides
Liang Zhang , Abhinav Sankara Raman , Aleksandra Vojvodic
2018 AIChE Annual Meeting
2018