Publications

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Published

1. V. Sharma, L.A. Collins, A.J. White, Stochastic and Mixed Density Functional Theory within the projector augmented wave formalism for the simulation of warm dense matter.
   arXiv version: https://arxiv.org/abs/2301.12018
   Accepted for publication as a Letter in Physical Review E.
   
   
2. V. Sharma, B. Bein, A. Lai, B. Pamuk, C.E. Dreyer, M. Fernández-Serra, and M. Dawber, Cooperative Interactions between Surface Terminations Explain Photocatalytic Water Splitting Activity on SrTiO3, PRX Energy 1, 023002.
   Published version: https://journals.aps.org/prxenergy/abstract/10.1103/PRXEnergy.1.023002
   
   
3. V. Sharma and M. Fernández-Serra, Proton-transfer dynamics in ionized water chains using real-time Time Dependent Density Functional Theory, Phys. Rev. Research 2 (2020) 043082.
   arXiv version: https://arxiv.org/abs/2007.11569
   Published version: https://link.aps.org/doi/10.1103/PhysRevResearch.2.043082
   
   
4. S. Cheng, V. Sharma, A.S. Poyraz, L. Wu, X. Li, A.C. Marschilok, E.S. Takeuchi, K.J. Takeuchi, M. Fernández-Serra, and Y. Zhu, Water-induced formation of an alkali-ion dimer in cryptomelane nanorods, Chem. Sci. 11 (2020) 4991.
   arXiv version: https://arxiv.org/abs/2007.11223
   Published version: https://pubs.rsc.org/en/content/articlelanding/2020/SC/D0SC01517B
   
   
   

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