Rajeev S. Assary - Search Results

Year	Number of Results
2010	1
2011	6
2012	5
2013	4
2014	5
2015	2
2016	1
2017	1
2018	1
2019	3
2020	4
2021	2
2022	5
2023	5
2024	4

1

A Long-Cycle-Life Lithium-CO₂ Battery with Carbon Neutrality.

Ahmadiparidari A, Warburton RE, Majidi L, Asadi M, Chamaani A, Jokisaari JR, Rastegar S, Hemmat Z, Sayahpour B, Assary RS, Narayanan B, Abbasi P, Redfern PC, Ngo A, Vörös M, Greeley J, Klie R, Curtiss LA, Salehi-Khojin A. Ahmadiparidari A, et al. Among authors: assary rs. Adv Mater. 2019 Oct;31(40):e1902518. doi: 10.1002/adma.201902518. Epub 2019 Aug 22. Adv Mater. 2019. PMID: 31441124

2

Coordination-Dependent Chemical Reactivity of TFSI Anions at a Mg Metal Interface.

Prabhakaran V, Agarwal G, Howard JD, Wi S, Shutthanandan V, Nguyen DT, Soule L, Johnson GE, Liu YS, Yang F, Feng X, Guo J, Hankins K, Curtiss LA, Mueller KT, Assary RS, Murugesan V. Prabhakaran V, et al. Among authors: assary rs. ACS Appl Mater Interfaces. 2023 Feb 8;15(5):7518-7528. doi: 10.1021/acsami.2c18477. Epub 2023 Jan 30. ACS Appl Mater Interfaces. 2023. PMID: 36715357

3

E_min: A First-Principles Thermochemical Descriptor for Predicting Molecular Synthesizability.

Lee AS, Elliott S, Harb H, Ward L, Foster I, Curtiss L, Assary RS. Lee AS, et al. Among authors: assary rs. J Chem Inf Model. 2024 Feb 26;64(4):1277-1289. doi: 10.1021/acs.jcim.3c01583. Epub 2024 Feb 15. J Chem Inf Model. 2024. PMID: 38359461

4

Competitive Pi-Stacking and H-Bond Piling Increase Solubility of Heterocyclic Redoxmers.

Zhao Y, Sarnello ES, Robertson LA, Zhang J, Shi Z, Yu Z, Bheemireddy SR, Z Y, Li T, Assary RS, Cheng L, Zhang Z, Zhang L, Shkrob IA. Zhao Y, et al. Among authors: assary rs. J Phys Chem B. 2020 Nov 19;124(46):10409-10418. doi: 10.1021/acs.jpcb.0c07647. Epub 2020 Nov 6. J Phys Chem B. 2020. PMID: 33158362

5

Active Learning Guided Computational Discovery of Plant-Based Redoxmers for Organic Nonaqueous Redox Flow Batteries.

Jain A, Shkrob IA, Doan HA, Adams K, Moore JS, Assary RS. Jain A, et al. Among authors: assary rs. ACS Appl Mater Interfaces. 2023 Dec 20;15(50):58309-58319. doi: 10.1021/acsami.3c11741. Epub 2023 Dec 10. ACS Appl Mater Interfaces. 2023. PMID: 38071647

6

Fluorination Enables Simultaneous Improvements of a Dialkoxybenzene-Based Redoxmer for Nonaqueous Redox Flow Batteries.

Bheemireddy SR, Li Z, Zhang J, Agarwal G, Robertson LA, Shkrob IA, Assary RS, Zhang Z, Wei X, Cheng L, Zhang L. Bheemireddy SR, et al. Among authors: assary rs. ACS Appl Mater Interfaces. 2022 Jun 29;14(25):28834-28841. doi: 10.1021/acsami.2c04926. Epub 2022 Jun 16. ACS Appl Mater Interfaces. 2022. PMID: 35709493

7

A KMnO₄-Generated Colloidal Electrolyte for Redox Mediation and Anode Protection in a Li-Air Battery.

Rastegar S, Ahmadiparidari A, Singh SK, Zhang C, Hemmat Z, Dandu N, Counihan MJ, Bagheri M, Rojas T, Majidi L, Wang S, Jaradat A, Assary RS, Redfern PC, Mirbod P, Tepavcevic S, Subramanian A, Ngo AT, Curtiss LA, Salehi-Khojin A. Rastegar S, et al. Among authors: assary rs. ACS Nano. 2022 Nov 22;16(11):18187-18199. doi: 10.1021/acsnano.2c05305. Epub 2022 Nov 3. ACS Nano. 2022. PMID: 36326201

8

Accurate quantum chemical energies for 133 000 organic molecules.

Narayanan B, Redfern PC, Assary RS, Curtiss LA. Narayanan B, et al. Among authors: assary rs. Chem Sci. 2019 Jun 27;10(31):7449-7455. doi: 10.1039/c9sc02834j. eCollection 2019 Aug 21. Chem Sci. 2019. PMID: 31489167 Free PMC article.

9

Interactions of CO₂ Anion Radicals with Electrolyte Environments from First-Principles Simulations.

Cencer MM, Li C, Agarwal G, Gomes Neto RJ, Amanchukwu CV, Assary RS. Cencer MM, et al. Among authors: assary rs. ACS Omega. 2022 May 17;7(21):18131-18138. doi: 10.1021/acsomega.2c01733. eCollection 2022 May 31. ACS Omega. 2022. PMID: 35664611 Free PMC article.

10

Accurate Prediction of Adiabatic Ionization Potentials of Organic Molecules using Quantum Chemistry Assisted Machine Learning.

Dandu NK, Ward L, Assary RS, Redfern PC, Curtiss LA. Dandu NK, et al. Among authors: assary rs. J Phys Chem A. 2023 Jul 20;127(28):5914-5920. doi: 10.1021/acs.jpca.3c00823. Epub 2023 Jul 5. J Phys Chem A. 2023. PMID: 37406209

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