2023
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A battery dataset for electric vertical takeoff and landing aircraft.
Alexander Bills, Shashank Sripad, Leif Fredericks, Matthew Guttenberg, Devin Charles, Evan Frank, and Venkatasubramanian Viswanathan.
Scientific Data 10(1).
[abstract]
Electric vertical takeoff and landing aircraft have a unique duty cycle characterized by high discharge currents at the beginning and end of the mission (corresponding to takeoff and landing of the aircraft) and a moderate power requirement between them with no rest periods during the mission. Here, we generated a dataset of battery duty profiles for an electric vertical takeoff and landing aircraft using a cell typical for that application. The dataset features 22 cells, comprising a total of 21,392 charge and discharge cycles. 3 of the cells use the baseline cycle while each of the other cells vary either charge current, discharge power, discharge duration, ambient cooling conditions, or end of charge voltage. While it was designed to mimic the expected duty cycle of an electric aircraft, this dataset is relevant for training machine learning models on battery life, fitting physical or empirical models for battery performance and/or degradation, and countless other applications.
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Differentiable physics-enabled closure modeling for Burgers' turbulence.
Varun Shankar, Vedant Puri, Ramesh Balakrishnan, Romit Maulik, and Venkatasubramanian Viswanathan.
Machine Learning: Science and Technology 4(1).
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2022
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Effect of Disorder and Doping on Electronic Structure and Diffusion Properties of Li₃V₂O₅.
Mohammad Babar, Hasnain Hafiz, Zeeshan Ahmad, Bernardo Barbiellini, Arun Bansil, and Venkatasubramanian Viswanathan.
The Journal of Physical Chemistry C 126(37).
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Autonomous optimization of non-aqueous Li-ion battery electrolytes via robotic experimentation and machine learning coupling.
Adarsh Dave, Jared Mitchell, Sven Burke, Hongyi Lin, Jay Whitacre, and Venkatasubramanian Viswanathan.
Nature Communications 13(1).
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Proton Donors Induce a Differential Transport Effect for Selectivity toward Ammonia in Lithium-Mediated Nitrogen Reduction.
Nikifar Lazouski, Katherine J. Steinberg, Michal L. Gala, Dilip Krishnamurthy, Venkatasubramanian Viswanathan, and Karthish Manthiram.
ACS Catalysis.
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Tunable angle-dependent electrochemistry at twisted bilayer graphene with moiré flat bands.
Yun Yu, Kaidi Zhang, Holden Parks, Mohammad Babar, Stephen Carr, Isaac M. Craig, Madeline Van Winkle, Artur Lyssenko, Takashi Taniguchi, Kenji Watanabe, Venkatasubramanian Viswanathan, and D. Kwabena Bediako.
Nature Chemistry 14(3).
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AutoMat: Automated materials discovery for electrochemical systems.
Emil Annevelink, Rachel Kurchin, Eric Muckley, Lance Kavalsky, Vinay I Hegde, Valentin Sulzer, Shang Zhu, Jiankun Pu, David Farina, Matthew Johnson, and others.
MRS Bulletin.
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Robust Analysis of 4e--Versus 6e--Reduction of Nitrogen on Metal Surfaces and Single-Atom Alloys.
Lydia Maria Tsiverioti, Lance Kavalsky, and Venkatasubramanian Viswanathan.
The Journal of Physical Chemistry C 126(31).
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By how much can closed-loop frameworks accelerate computational materials discovery?.
Lance Kavalsky, Vinay I Hegde, Eric Muckley, Matthew S Johnson, Bryce Meredig, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:2211.10533.
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Reversible Alkaline Hydrogen Evolution and Oxidation Reactions Using Ni-Mo Catalysts Supported on Carbon.
Rituja Patil, Manjodh Kaur, Stephen House, Lance Kavalsky, Keda Hu, Shirley Zhong, Dilip Krishnamurthy, Venkatasubramanian Viswanathan, Judith Yang, Yushan Yan, and others.
ChemRxiv preprint.
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Super-linear Scaling Behavior for Electric Vehicle Chargers and Road Map to Addressing the Infrastructure Gap.
Alexius Wadell, Matthew Guttenberg, Christopher P. Kempes, and Venkatasubramanian Viswanathan.
arXiv.
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The challenges and opportunities of battery-powered flight.
Venkatasubramanian Viswanathan, Alan H. Epstein, Yet-Ming Chiang, Esther Takeuchi, Marty Bradley, John Langford, and Michael Winter.
Nature 601(7894).
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2021
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A minimal information set to enable verifiable theoretical battery research.
Aashutosh Mistry, Ankit Verma, Shashank Sripad, Rebecca Ciez, Valentin Sulzer, Ferran Brosa Planella, Robert Timms, Yumin Zhang, Rachel Kurchin, Philipp Dechent, Weihan Li, Samuel Greenbank, Zeeshan Ahmad, Dilip Krishnamurthy, Alexis M. Fenton, Kevin Tenny, Prehit Patel, Daniel Juarez Robles, Paul Gasper, Andrew Colclasure, Artem Baskin, Corinne D. Scown, Venkat R. Subramanian, Edwin Khoo, Srikanth Allu, David Howey, Steven DeCaluwe, Scott A. Roberts, and Venkatasubramanian Viswanathan.
ACS Energy Letters.
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Direct Integration of Strained-Pt Catalysts into Proton-Exchange-Membrane Fuel Cells with Atomic Layer Deposition.
Shicheng Xu, Zhaoxuan Wang, Sam Dull, Yunzhi Liu, Dong Un Lee, Juan S. Lezama Pacheco, Marat Orazov, Per Erik Vullum, Anup Lal Dadlani, Olga Vinogradova, Peter Schindler, Qizhan Tam, Thomas D. Schladt, Jonathan E. Mueller, Sebastian Kirsch, Gerold Huebner, Drew Higgins, Jan Torgersen, Venkatasubramanian Viswanathan, Thomas Francisco Jaramillo, and Fritz B. Prinz.
Advanced Materials n/a(n/a).
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A Review of Safety Considerations for Batteries in Aircraft with Electric Propulsion.
Shashank Sripad, Alexander Bills, and Venkatasubramanian Viswanathan.
MRS Bulletin.
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Tomographic Reconstruction of Oxygen Orbitals in Lithium-Rich Battery Materials.
Hasnain Hafiz, Kosuke Suzuki, Bernardo Barbiellini, Naruki Tsuji, Naoaki Yabuuchi, Kentaro Yamamoto, Yuki Orikasa, Yoshiharu Uchimoto, Yoshiharu Sakurai, Hiroshi Sakurai, Arun Bansil, and Venkatasubramanian Viswanathan.
Nature 594(7862).
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Co-Electrodeposition Mechanism in Rechargeable Metal Batteries.
Bairav S. Vishnugopi, Feng Hao, Ankit Verma, Lauren E. Marbella, Venkatasubramanian Viswanathan, and Partha P. Mukherjee.
ACS Energy Letters.
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Interfaces in Solid Electrolyte Interphase: Implications for Lithium-Ion Batteries.
Zeeshan Ahmad, Victor Venturi, Hasnain Hafiz, and Venkatasubramanian Viswanathan.
The Journal of Physical Chemistry C.
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Semi-Solid Alkali Metal Electrodes Enabling High Critical Current Densities in Solid Electrolyte Batteries.
Richard J.-Y. Park, Christopher M. Eschler, Cole D. Fincher, Andres F. Badel, Pinwen Guan, Matt Pharr, Brian W. Sheldon, W. Craig Carter, Venkatasubramanian Viswanathan, and Yet-Ming Chiang.
Nature Energy 6(3).
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Thermodynamics of Lithium Stripping and Limits for Fast Discharge in Lithium Metal Batteries.
Victor Venturi and Venkatasubramanian Viswanathan.
arXiv:2103.03921 [cond-mat, physics:physics].
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INCEPTS: Software for High-Fidelity Electric Vehicle En Route State of Charge Estimation, Fleet Analysis and Charger Deployment.
Matthew Guttenberg, Shashank Sripad, Alexander Bills, and Venkatasubramanian Viswanathan.
eTransportation.
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Predicting the impact of formation protocols on battery lifetime immediately after manufacturing.
Andrew Weng, Peyman Mohtat, Peter M Attia, Valentin Sulzer, Suhak Lee, Greg Less, and Anna Stefanopoulou.
Joule 5(11).
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The promise of energy-efficient battery-powered urban aircraft.
Shashank Sripad and Venkatasubramanian Viswanathan.
Proceedings of the National Academy of Sciences 118(45).
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Validation and parameterization of a novel physics-constrained neural dynamics model applied to turbulent fluid flow.
Varun Shankar, Gavin D. Portwood, Arvind T. Mohan, Peetak P. Mitra, Dilip Krishnamurthy, Christopher Rackauckas, Lucas A. Wilson, David P. Schmidt, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:2110.11528.
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Principles of the Battery Data Genome.
Logan Ward, Susan Babinec, Eric J Dufek, Venkatasubramanian Viswanathan, Muratahan Aykol, David AC Beck, Ben Blasizk, Bor-Rong Chen, George Crabtree, Valerio Angelis, and others.
arXiv preprint arXiv:2109.07278.
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Chemomechanics: friend or foe of the'AND problem'of solid-state batteries?.
Zeeshan Ahmad, Victor Venturi, Shashank Sripad, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:2108.10150.
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The Iron-Age of Storage Batteries: Techno-Economic Promises and Challenges.
Shashank Sripad, Dilip Krishnamurthy, and Venkatasubramanian Viswanathan.
ECSarXiv.
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How Machine Learning Will Revolutionize Electrochemical Sciences.
Aashutosh Mistry, Alejandro A. Franco, Samuel J. Cooper, Scott A. Roberts, and Venkatasubramanian Viswanathan.
ACS Energy Letters.
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Distinguishing Among High Activity Electrocatalysts: Regression vs Classification.
Olga Vinogradova and Venkatasubramanian Viswanathan.
The Journal of Physical Chemistry C.
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2020
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Lithium Peroxide Growth in Li-O2 Batteries via Chemical Disproportionation and Electrochemical Mechanisms: A Potential-Dependent Ab Initio Study with Implicit Solvation.
Justin B. Haskins, Hieu H. Pham, Abhishek Khetan, Venkatasubramanian Viswanathan, and John W. Lawson.
The Journal of Physical Chemistry C 125(1).
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Autonomous Discovery of Battery Electrolytes with Robotic Experimentation and Machine Learning.
Adarsh Dave, Jared Mitchell, Kirthevasan Kandasamy, Han Wang, Sven Burke, Biswajit Paria, Barnabás Póczos, Jay Whitacre, and Venkatasubramanian Viswanathan.
Cell Reports Physical Science 1(12).
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An accurate machine learning calculator for the lithium-graphite system.
Mohammad Babar, Holden L Parks, Gregory Houchins, and Venkatasubramanian Viswanathan.
Journal of Physics: Energy 3(1).
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Free Radicals: Making a Case for Battery Modeling.
David A. Howey, Scott A. Roberts, Venkatasubramanian Viswanathan, Aashutosh Mistry, Martin Beuse, Edwin Khoo, and Steven C. DeCaluwe.
Electrochemical Society Interface 29(4).
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Kinetics of lithium electrodeposition and stripping.
Shashank Sripad, Daniel Korff, Steven C. DeCaluwe, and Venkatasubramanian Viswanathan.
The Journal of Chemical Physics 153(19).
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Leveraging Cation Identity to Engineer Solid Electrolyte Interphases for Rechargeable Lithium Metal Anodes.
Richard May, Yumin Zhang, Steven R. Denny, Venkatasubramanian Viswanathan, and Lauren E. Marbella.
Cell Reports Physical Science 1(11).
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Design principles for self-forming interfaces enabling stable lithium-metal anodes.
Yingying Zhu, Vikram Pande, Linsen Li, Bohua Wen, Menghsuan Sam Pan, David Wang, Zi-Feng Ma, Venkatasubramanian Viswanathan, and Yet-Ming Chiang.
Proceedings of the National Academy of Sciences 117(44).
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Design rules for liquid crystalline electrolytes for enabling dendrite-free lithium metal batteries.
Zeeshan Ahmad, Zijian Hong, and Venkatasubramanian Viswanathan.
Proceedings of the National Academy of Sciences 117(43).
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Beyond Transition Metal Oxide Cathodes for Electric Aviation: The Case of Rechargeable CFx.
Venkatesh Krishnamurthy and Venkatasubramanian Viswanathan.
ACS Energy Letters 5(11).
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Marcus-Hush-Chidsey kinetics at electrode-electrolyte interfaces.
Rachel Kurchin and Venkatasubramanian Viswanathan.
The Journal of Chemical Physics 153(13).
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Open-Sourcing Phase-Field Simulations for Accelerating Energy Materials Design and Optimization.
Zijian Hong and Venkatasubramanian Viswanathan.
ACS Energy Letters 5(10).
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Not All Fluorination Is the Same: Unique Effects of Fluorine Functionalization of Ethylene Carbonate for Tuning Solid-Electrolyte Interphase in Li Metal Batteries.
Yumin Zhang and Venkatasubramanian Viswanathan.
Langmuir 36(39).
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Uncertainty quantification in first-principles predictions of phonon properties and lattice thermal conductivity.
Holden L. Parks, Hyun-Young Kim, Venkatasubramanian Viswanathan, and Alan J. H. McGaughey.
Physical Review Materials 4(8).
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Machine learning enabled discovery of application dependent design principles for two-dimensional materials.
Victor Venturi, Holden L Parks, Zeeshan Ahmad, and Venkatasubramanian Viswanathan.
Machine Learning: Science and Technology 1(3).
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Universal chemomechanical design rules for solid-ion conductors to prevent dendrite formation in lithium metal batteries.
Chengyin Fu, Victor Venturi, Jinsoo Kim, Zeeshan Ahmad, Andrew W. Ells, Venkatasubramanian Viswanathan, and Brett A. Helms.
Nature Materials 19(7).
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Engineering three-dimensional (3D) out-of-plane graphene edge sites for highly selective two-electron oxygen reduction electrocatalysis.
Daniel San Roman, Dilip Krishnamurthy, Raghav Garg, Hasnain Hafiz, Michael Lamparski, Noel T. Nuhfer, Vincent Meunier, Venkatasubramanian Viswanathan, and Tzahi Cohen-Karni.
ACS Catalysis 10(3).
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Performance Metrics Required of Next-Generation Batteries to Electrify Commercial Aircraft.
Alexander Bills, Shashank Sripad, William Leif Fredericks, Madalsa Singh, and Venkatasubramanian Viswanathan.
ACS Energy Letters 5(2).
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Challenges in Lithium Metal Anodes for Solid-State Batteries.
Kelsey B. Hatzell, Xi Chelsea Chen, Corie L. Cobb, Neil P. Dasgupta, Marm B. Dixit, Lauren E. Marbella, Matthew T. McDowell, Partha P. Mukherjee, Ankit Verma, Venkatasubramanian Viswanathan, Andrew S. Westover, and Wolfgang G. Zeier.
ACS Energy Letters 5(3).
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Uncertainty Quantification of First Principles Computational Phase Diagram Predictions of Li-Si System Via Bayesian Sampling.
Ying Yuan, Gregory Houchins, Pin-Wen Guan, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:2003.13393.
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Engineering Solid Electrolyte Interphase Composition by Assessing Decomposition Pathways of Fluorinated Organic Solvents in Lithium Metal Batteries.
Yumin Zhang, Dilip Krishnamurthy, and Venkatasubramanian Viswanathan.
Journal of The Electrochemical Society 167(7).
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Mechanism for Singlet Oxygen Production in Li-Ion and Metal-Air Batteries.
Gregory Houchins, Vikram Pande, and Venkatasubramanian Viswanathan.
ACS Energy Letters 5(6).
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Fostering a Sustainable Community in Batteries.
Jenny A. Baker, Martin Beuse, Steven C. Decaluwe, Linda W. Jing, Edwin Khoo, Shashank Sripad, Ulderico Ulissi, Ankit Verma, Andrew A. Wang, Yen T. Yeh, Nicholas Yiu, David A. Howey, and Venkatasubramanian Viswanathan.
ACS Energy Letters 5(7).
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Design Principles for Dendrite Suppression with Porous Polymer/Aqueous Solution Hybrid Electrolyte for Zn Metal Anodes.
Zijian Hong, Zeeshan Ahmad, and Venkatasubramanian Viswanathan.
ACS Energy Letters 5(8).
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Trade-offs between automation and light vehicle electrification.
Aniruddh Mohan, Shashank Sripad, Parth Vaishnav, and Venkatasubramanian Viswanathan.
Nature Energy 5(7).
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Universal Battery Performance and Degradation Model for Electric Aircraft.
Alexander Bills, Shashank Sripad, William L. Fredericks, Matthew Guttenberg, Devin Charles, Evan Frank, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:2008.01527.
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Robust Active Site Design of Single Atom Catalysts for Electrochemical Ammonia Synthesis.
Lance Kavalsky and Venkatasubramanian Viswanathan.
The Journal of Physical Chemistry C 124(42).
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Combining pressure and electrochemistry to synthesize palladium superhydrides.
Pin-Wen Guan, Russell J Hemley, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:2007.15613.
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An accurate machine-learning calculator for optimization of Li-ion battery cathodes.
Gregory Houchins and Venkatasubramanian Viswanathan.
Journal of Chemical Physics 153(5).
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Towards Ultra Low Cobalt Cathodes: A High Fidelity Phase Search Incorporating Uncertainty Quantification of Li-Ni-Mn-Co Oxides.
Gregory Houchins and Venkatasubramanian Viswanathan.
J. Electrochem. Soc. 167(7).
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An Autonomous Electrochemical Test stand for Machine Learning Informed Electrolyte Optimization.
Jay F Whitacre, Jared Mitchell, Adarsh Dave, Sven Burke, and Venkatasburamanian Viswanathan.
J. Electrochem. Soc..
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Closed-Loop Design of Proton Donors for Lithium-Mediated Ammonia Production with Interpretable Models and Molecular Machine Learning.
Dilip Krishnamurthy, Nikifar Lazouski, Michal L Gala, Karthish Manthiram, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:2008.08078.
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2019
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Quantifying the Economic Case for Electric Semi-Trucks.
Shashank Sripad and Venkatasubramanian Viswanathan.
ACS Energy Letters 4(1).
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Quantifying robustness of DFT predicted pathways and activity determining elementary steps for electrochemical reactions.
Dilip Krishnamurthy, Vaidish Sumaria, and Venkatasubramanian Viswanathan.
Journal of Chemical Physics 150(4).
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Uncertainty Quantification in First-Principles Predictions of Harmonic Vibrational Frequencies of Molecules and Molecular Complexes.
Holden L. Parks, Alan J.H. McGaughey, and Venkatasubramanian Viswanathan.
Journal of Physical Chemistry C 123(7).
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Potential for electric aircraft.
Venkatasubramanian Viswanathan and B. Matthew Knapp.
Nature Sustainability 2(2).
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Theoretical characterization of structural disorder in the tetramer model structure of eumelanin.
Oleg Sapunkov, Abhishek Khetan, Vikram Pande, and Venkatasubramanian Viswanathan.
Physical Review Materials 3(10).
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The role of uncertainty quantification and propagation in accelerating the discovery of electrochemical functional materials.
Gregory Houchins, Dilip Krishnamurthy, and Venkatasubramanian Viswanathan.
MRS Bulletin 44(3).
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Design Principles for Self-forming Interfaces Enabling Stable Lithium Metal Anodes.
Yingying Zhu, Vikram Pande, Linsen Li, Sam Pan, Bohua Wen, David Wang, Venkatasubramanian Viswanathan, and Yet-Ming Chiang.
arXiv preprint arXiv:1903.09593.
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Prospect of Thermal Shock Induced Healing of Lithium Dendrite.
Zijian Hong and Venkatasubramanian Viswanathan.
ACS Energy Letters 4(5).
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Electron Transport in Multidimensional Fuzzy Graphene Nanostructures.
Raghav Garg, Devashish P. Gopalan, Sergio C. Barrera, Hasnain Hafiz, Noel T. Nuhfer, Venkatasubramanian Viswanathan, Benjamin M. Hunt, and Tzahi Cohen-Karni.
Nano Letters 19(8).
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Dendrite suppression of metal electrodeposition with liquid crystalline electrolytes.
Zeeshan Ahmad, Zijian Hong, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:1907.04441.
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Descriptors for Electrolyte-Renormalized Oxidative Stability of Solvents in Lithium-Ion Batteries.
Vikram Pande and Venkatasubramanian Viswanathan.
Journal of Physical Chemistry Letters 10(22).
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Computational Screening of Current Collectors for Enabling Anode-Free Lithium Metal Batteries.
Vikram Pande and Venkatasubramanian Viswanathan.
ACS Energy Letters 4(12).
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Uncertainty quantification of DFT-predicted finite temperature thermodynamic properties within the Debye model.
Pin Wen Guan, Gregory Houchins, and Venkatasubramanian Viswanathan.
Journal of Chemical Physics 151(24).
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The Future of Vehicle Electrification in India May Ride on Two Wheels.
Shashank Sripad, Tarun Mehta, Anil Srivastava, and Venkatasubramanian Viswanathan.
ACS Energy Letters 4(11).
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Autonomous discovery of battery electrolytes with robotic experimentation and machine-learning.
Adarsh Dave, Jared Mitchell, Kirthevasan Kandasamy, Sven Burke, Biswajit Paria, Barnabas Poczos, Jay Whitacre, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:2001.09938.
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The Materials Research Platform: Defining the Requirements from User Stories.
Muratahan Aykol, Jens S. Hummelshøj, Abraham Anapolsky, Koutarou Aoyagi, Martin Z. Bazant, Thomas Bligaard, Richard D. Braatz, Scott Broderick, Daniel Cogswell, John Dagdelen, Walter Drisdell, Edwin Garcia, Krishna Garikipati, Vikram Gavini, William E. Gent, Livia Giordano, Carla P. Gomes, Rafael Gomez-Bombarelli, Chirranjeevi Balaji Gopal, John M. Gregoire, Jeffrey C. Grossman, Patrick Herring, Linda Hung, Thomas F. Jaramillo, Laurie King, Ha Kyung Kwon, Ryosuke Maekawa, Andrew M. Minor, Joseph H. Montoya, Tim Mueller, Colin Ophus, Krishna Rajan, Rampi Ramprasad, Brian Rohr, Daniel Schweigert, Yang Shao-Horn, Yoshinori Suga, Santosh K. Suram, Venkatasubramanian Viswanathan, Jay F. Whitacre, Adam P. Willard, Olga Wodo, Chris Wolverton, and Brian D. Storey.
Matter 1(6).
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Benchmarking conductivity predictions of the Advanced Electrolyte Model (AEM) for aqueous systems.
Adarsh Dave, Kevin L Gering, Jared M Mitchell, Jay Whitacre, and Venkatasubramanian Viswanathan.
Journal of The Electrochemical Society 167(1).
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2018
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Robust high-fidelity DFT study of the lithium-graphite phase diagram.
Vikram Pande and Venkatasubramanian Viswanathan.
Physical Review Materials 2(12).
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Role of Disorder in NaO2 and Its Implications for Na-O2 Batteries.
Oleg Sapunkov, Vikram Pande, Abhishek Khetan, and Venkatasubramanian Viswanathan.
Journal of Physical Chemistry C 122(33).
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Maximal Predictability Approach for Identifying the Right Descriptors for Electrocatalytic Reactions.
Dilip Krishnamurthy, Vaidish Sumaria, and Venkatasubramanian Viswanathan.
Journal of Physical Chemistry Letters 9(3).
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Comment on "alternative strategy for a safe rechargeable battery" by M. H. Braga, N. S. Grundish, A. J. Murchison and J. B. Goodenough, Energy Environ. Sci., 2017, 10, 331-336.
Daniel A. Steingart and Venkatasubramanian Viswanathan.
Energy and Environmental Science 11(1).
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Understanding Ion Pairing in High-Salt Concentration Electrolytes Using Classical Molecular Dynamics Simulations and Its Implications for Nonaqueous Li-O2 Batteries.
Abhishek Khetan, Hamid R. Arjmandi, Vikram Pande, Heinz Pitsch, and Venkatasubramanian Viswanathan.
Journal of Physical Chemistry C 122(15).
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Quantifying Confidence in DFT Predicted Surface Pourbaix Diagrams and Associated Reaction Pathways for Chlorine Evolution.
Vaidish Sumaria, Dilip Krishnamurthy, and Venkatasubramanian Viswanathan.
ACS Catalysis 8(10).
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Towards Synergistic Electrode-Electrolyte Design Principles for Nonaqueous Li-O2 batteries.
Abhishek Khetan, Dilip Krishnamurthy, and Venkatasubramanian Viswanathan.
Topics in Current Chemistry 376(2).
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Phase-Field Simulations of Lithium Dendrite Growth with Open-Source Software.
Zijian Hong and Venkatasubramanian Viswanathan.
ACS Energy Letters 3(7).
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Exploring MXenes as Cathodes for Non-Aqueous Lithium-Oxygen Batteries: Design Rules for Selectively Nucleating Li2O2.
Andrew Lee, Dilip Krishnamurthy, and Venkatasubramanian Viswanathan.
ChemSusChem 11(12).
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Machine Learning Enabled Computational Screening of Inorganic Solid Electrolytes for Suppression of Dendrite Formation in Lithium Metal Anodes.
Zeeshan Ahmad, Tian Xie, Chinmay Maheshwari, Jeffrey C. Grossman, and Venkatasubramanian Viswanathan.
ACS Central Science 4(8).
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Regulating hot and cold.
Jonathan A. Malen and Venkatasubramanian Viswanathan.
Nature Energy 3(10).
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Metal-Oxide Supported Pt Catalysts for Oxygen Reduction Reaction: A Density Functional Theory Approach.
Olga Vinogradova, Dilip Krishnamurthy, Lin Li, and Venkatasubramanian Viswanathan.
2018 AIChE Annual Meeting.
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Quantifying Confidence in DFT-Predicted Surface Pourbaix Diagrams of Transition-Metal Electrode-Electrolyte Interfaces.
Olga Vinogradova, Dilip Krishnamurthy, Vikram Pande, and Venkatasubramanian Viswanathan.
Langmuir 34(41).
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Performance metrics required of next-generation batteries to electrify vertical takeoff and landing (VTOL) aircraft.
William L Fredericks, Shashank Sripad, Geoffrey C Bower, and Venkatasubramanian Viswanathan.
ACS Energy Letters 3(12).
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Machine learning based approaches to accelerate energy materials discovery and optimization.
Dilip Krishnamurthy, Hasso Weiland, Amir Barati Farimani, Erin Antono, Josh Green, and Venkatasubramanian Viswanathan.
ACS Energy Letters 4(1).
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2017
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Enhanced strength and temperature dependence of mechanical properties of Li at small scales and its implications for Li metal anodes.
Chen Xu, Zeeshan Ahmad, Asghar Aryanfar, Venkatasubramanian Viswanathan, and Julia R. Greer.
Proceedings of the National Academy of Sciences of the United States of America 114(1).
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Plug-in hybrid electric vehicle LiFePO4 battery life implications of thermal management, driving conditions, and regional climate.
Tugce Yuksel, Shawn Litster, Venkatasubramanian Viswanathan, and Jeremy J. Michalek.
Journal of Power Sources.
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Criteria and considerations for the selection of redox mediators in nonaqueous Li-O2 batteries.
Vikram Pande and Venkatasubramanian Viswanathan.
ACS Energy Letters 2(1).
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One- or Two-Electron Water Oxidation, Hydroxyl Radical, or H2O2 Evolution.
Samira Siahrostami, Guo Ling Li, Venkatasubramanian Viswanathan, and Jens K. Nørskov.
Journal of Physical Chemistry Letters 8(6).
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Stability of Electrodeposition at Solid-Solid Interfaces and Implications for Metal Anodes.
Zeeshan Ahmad and Venkatasubramanian Viswanathan.
Physical Review Letters 119(5).
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Synthesis and Measurement of Cohesive Mechanics in Polydopamine Nanomembranes.
Luke Klosterman, Zeeshan Ahmad, Venkatasubramanian Viswanathan, and Christopher J. Bettinger.
Advanced Materials Interfaces 4(10).
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Effect of dynamic surface polarization on the oxidative stability of solvents in nonaqueous Li- O2 batteries.
Abhishek Khetan, Heinz Pitsch, and Venkatasubramanian Viswanathan.
Physical Review Materials 1(4).
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Quantifying confidence in density functional theory predictions of magnetic ground states.
Gregory Houchins and Venkatasubramanian Viswanathan.
Physical Review B 96(13).
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Review -- Practical Challenges Hindering the Development of Solid State Li Ion Batteries.
Kian Kerman, Alan Luntz, Venkatasubramanian Viswanathan, Yet-Ming Chiang, and Zhebo Chen.
Journal of The Electrochemical Society 164(7).
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Performance Metrics Required of Next-Generation Batteries to Make a Practical Electric Semi Truck.
Shashank Sripad and Venkatasubramanian Viswanathan.
ACS Energy Letters 2(7).
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Evaluation of Current, Future, and Beyond Li-Ion Batteries for the Electrification of Light Commercial Vehicles: Challenges and Opportunities.
Shashank Sripad and Venkatasubramanian Viswanathan.
Journal of The Electrochemical Society 164(11).
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Surface Restructuring of Nickel Sulfide Generates Optimally Coordinated Active Sites for Oxygen Reduction Catalysis.
Bing Yan, Dilip Krishnamurthy, Christopher H. Hendon, Siddharth Deshpande, Yogesh Surendranath, and Venkatasubramanian Viswanathan.
Joule 1(3).
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Role of anisotropy in determining stability of electrodeposition at solid-solid interfaces.
Zeeshan Ahmad and Venkatasubramanian Viswanathan.
Physical Review Materials 1(5).
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Evaluating the Potential of Platooning in Lowering the Required Performance Metrics of Li-Ion Batteries to Enable Practical Electric Semi-Trucks.
Matthew Guttenberg, Shashank Sripad, and Venkatasubramanian Viswanathan.
ACS Energy Letters 2(11).
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Vulnerabilities of Electric Vehicle Battery Packs to Cyberattacks.
Shashank Sripad, Sekar Kulandaivel, Vikram Pande, Vyas Sekar, and Venkatasubramanian Viswanathan.
arXiv preprint arXiv:1711.04822.
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Single-ion homopolymer electrolytes with high transference number prepared by click chemistry and photoinduced metal-free atom-transfer radical polymerization.
Sipei Li, Alexander I Mohamed, Vikram Pande, Han Wang, Julia Cuthbert, Xiangcheng Pan, Hongkun He, Zongyu Wang, Venkatasubramanian Viswanathan, Jay F Whitacre, and Others.
ACS Energy Letters 3(1).
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2016
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Identifying Material and Device Targets for a Flare Gas Recovery System Utilizing Electrochemical Conversion of Methane to Methanol.
Patcharapit Promoppatum and Venkatasubramanian Viswanathan.
ACS Sustainable Chemistry and Engineering 4(3).
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Evidence of Porphyrin-Like Structures in Natural Melanin Pigments Using Electrochemical Fingerprinting.
Young Jo Kim, Abhishek Khetan, Wei Wu, Sang Eun Chun, Venkatasubramanian Viswanathan, Jay F. Whitacre, and Christopher J. Bettinger.
Advanced Materials 28(16).
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Universality in Nonaqueous Alkali Oxygen Reduction on Metal Surfaces: Implications for Li-O2 and Na-O2 Batteries.
Dilip Krishnamurthy, Heine Anton Hansen, and Venkatasubramanian Viswanathan.
ACS Energy Letters 1(1).
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Quantification of uncertainty in first-principles predicted mechanical properties of solids: Application to solid ion conductors.
Zeeshan Ahmad and Venkatasubramanian Viswanathan.
Physical Review B 94(6).
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Rational design of new electrolyte materials for electrochemical double layer capacitors.
Christoph Schütter, Tamara Husch, Venkatasubramanian Viswanathan, Stefano Passerini, Andrea Balducci, and Martin Korth.
Journal of Power Sources.
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Quantifying Uncertainty in Activity Volcano Relationships for Oxygen Reduction Reaction.
Siddharth Deshpande, John R. Kitchin, and Venkatasubramanian Viswanathan.
ACS Catalysis 6(8).
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Comment on ``Cycling Li-O2 batteries via LiOH formation and decomposition''.
V Viswanathan, V Pande, K M Abraham, A C Luntz, B D McCloskey, and D Addison.
Science 352(6286).
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2015
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Trade-offs in capacity and rechargeability in nonaqueous Li-O2 batteries: Solution-driven growth versus nucleophilic stability.
Abhishek Khetan, Alan Luntz, and Venkatasubramanian Viswanathan.
Journal of Physical Chemistry Letters 6(7).
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Enhancing electrochemical intermediate solvation through electrolyte anion selection to increase nonaqueous Li-O2 battery capacity.
Colin M. Burke, Vikram Pande, Abhishek Khetan, Venkatasubramanian Viswanathan, and Bryan D. McCloskey.
Proceedings of the National Academy of Sciences of the United States of America 112(30).
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A dual-mode rechargeable lithium--bromine/oxygen fuel cell.
Peng Bai, Venkatasubramanian Viswanathan, and Martin Z Bazant.
Journal of Materials Chemistry A 3(27).
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Selective Electrochemical Generation of Hydrogen Peroxide from Water Oxidation.
Venkatasubramanian Viswanathan, Heine A. Hansen, and Jens K. Nørskov.
Journal of Physical Chemistry Letters 6(21).
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Quantifying the promise of `beyond' Li-ion batteries.
Oleg Sapunkov, Vikram Pande, Abhishek Khetan, Chayanit Choomwattana, and Venkatasubramanian Viswanathan.
Translational Materials Research 2(4).
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Fundamental Challenges Facing Next-Generation Li Ion Batteries.
Venkatasubramanian Viswanathan.
Journal of Physical Chemistry Letters 6(22).
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2014
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Unifying solution and surface electrochemistry: Limitations and opportunities in surface electrocatalysis.
Venkatasubramanian Viswanathan and Heine Anton Hansen.
Topics in Catalysis 57(1-4).
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Unifying kinetic and thermodynamic analysis of 2 e- and 4 e - reduction of oxygen on metal surfaces.
Heine A. Hansen, Venkatasubramanian Viswanathan, and Jens K. Nørskov.
Journal of Physical Chemistry C 118(13).
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Solvent degradation in nonaqueous Li-O2 batteries: Oxidative stability versus H-abstraction.
Abhishek Khetan, Heinz Pitsch, and Venkatasubramanian Viswanathan.
Journal of Physical Chemistry Letters 5(14).
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Nanoscale limitations in metal oxide electrocatalysts for oxygen evolution.
Venkatasubramanian Viswanathan, Katie L. Pickrahn, Alan C. Luntz, Stacey F. Bent, and Jens K. Nørskov.
Nano Letters 14(10).
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Identifying Descriptors for Solvent Stability in Non-Aqueous Li-O2 Batteries.
Abhishek Khetan, Heinz Pitsch, and Venkatasubramanian Viswanathan.
The Journal of Physical Chemistry Letters.
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Solvating additives drive solution-mediated electrochemistry and enhance toroid growth in non-aqueous Li--O2 batteries.
Nagaphani B Aetukuri, Bryan D McCloskey, Jeannette M García, Leslie E Krupp, Venkatasubramanian Viswanathan, and Alan C Luntz.
Nature Chemistry 7(1).
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