Publications per year
Publications per year
Overview
Education/Academic qualification
Eng-Chemical, Doctorate Degree
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Dive into the research topics where Dilip Asthagiri is active. These topic labels come from the works of this person. Together they form a unique fingerprint.
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Equipartition and the Temperature of Maximum Density of TIP4P/2005 Water 1
Asthagiri, D. N., Pinheiro dos Santos, T. & Beck, T. L., Jan 15 2026, In: Journal of Physical Chemistry B. 130, 2, p. 862-867 6 p.Research output: Contribution to journal › Article › peer-review
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Characterization of kerogen nanopores using 2D NMR relaxation and MD simulations
Singer, P. M., Liu, Y., Wang, X., Hirasaki, G. J., Valiya Parambathu, A., Chapman, W. G., Asthagiri, D. N., Vinegar, E. G. & Vinegar, H. J., Nov 2025, In: Magnetic Resonance Letters. 5, 4, 200220.Research output: Contribution to journal › Article › peer-review
Open Access1 Scopus citations -
Consequences of the failure of equipartition for the p-V behavior of liquid water and the hydration free energy components of a small protein
Asthagiri, D. N., Valiya Parambathu, A. & Beck, T. L., Mar 28 2025, In: Chemical Science. 16, 17, p. 7503-7512 10 p.Research output: Contribution to journal › Article › peer-review
Open Access1 Scopus citations -
Extended molecular eigenmodes treatment of dipole–dipole NMR relaxation in real fluids
Pinheiro dos Santos, T. J., Orcan-Ekmekci, B., Chapman, W. G., Singer, P. M. & Asthagiri, D. N., Nov 14 2025, In: Journal of Chemical Physics. 163, 18, 184105.Research output: Contribution to journal › Article › peer-review
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Molecular-Level Insights into the NMR Relaxivity of Gadobutrol Using Quantum and Classical Molecular Simulations
Pinheiro dos Santos, T. J., Fraenza, C. C., de Araujo Lima e Souza, G., Pelegano-Titmuss, E., Asthagiri, D. N., Greenbaum, S. G., Chapman, W. G. & Singer, P. M., Sep 22 2025, In: Chemical and Biomedical Imaging. 3, 9, p. 615-629 15 p.Research output: Contribution to journal › Article › peer-review
Open Access3 Scopus citations
Datasets
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Dataset for manuscript "Consequences of the failure of equipartition for the p-V behavior of liquid water and the hydration free energy components of a small protein"
Asthagiri, D. (Creator), Valiya Parambathu, A. (Creator) & Beck, T. (Creator), Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States), 2024
Dataset