Larry A Curtiss (Larry Curtiss)

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 35

Top Topics

Molecular Dynamics Simulations

Machine Learning

Room Temperature

Top Venues

ACS applied materials & interfaces

The journal of physical chemistry. A

Journal of chemical information and modeling

Advanced science (Weinheim, Baden-Wurttemberg, Germany)

This page only lists publications with an associated author ORCID identifier.

Publications

Andrew S Lee, Sarah N Elliott, Hassan Harb, Logan Ward, Ian Foster, Larry A Curtiss, Rajeev S Assary
E min : A First-Principles Thermochemical Descriptor for Predicting Molecular Synthesizability. Journal of chemical information and modeling (2024)
Daniel Trainer, Alex Taekyung Lee, Sanjoy Sarkar, Vijay Singh, Xinyue Cheng, Naveen K Dandu, Kyaw Zin Latt, Shaoze Wang, Tolulope Michael Ajayi, Sineth Premarathna, David Facemyer, Larry A Curtiss, Sergio E Ulloa, Anh T Ngo, Eric Masson, Saw-Wai Hla
2D Ionic Liquid-Like State of Charged Rare-Earth Clusters on a Metal Surface. Advanced science (Weinheim, Baden-Wurttemberg, Germany) 11 (13) (2024)
Daniel Trainer, Alex Taekyung Lee, Sanjoy Sarkar, Vijay Singh, Xinyue Cheng, Naveen K Dandu, Kyaw Zin Latt, Shaoze Wang, Tolulope Michael Ajayi, Sineth Premarathna, David Facemyer, Larry A Curtiss, Sergio E Ulloa, Anh T Ngo, Eric Masson, Saw-Wai Hla
2D Ionic Liquid-Like State of Charged Rare-Earth Clusters on a Metal Surface. Advanced science (Weinheim, Baden-Wurttemberg, Germany) 11 (13) (2024)
Andrew S Lee, Sarah N Elliott, Hassan Harb, Logan Ward, Ian Foster, Larry A Curtiss, Rajeev S Assary
E min : A First-Principles Thermochemical Descriptor for Predicting Molecular Synthesizability. Journal of chemical information and modeling 64 (4) (2024)
Andrew S Lee, Sarah N Elliott, Hassan Harb, Logan Ward, Ian Foster, Larry A Curtiss, Rajeev S Assary
E min : A First-Principles Thermochemical Descriptor for Predicting Molecular Synthesizability. Journal of chemical information and modeling 64 (4) (2024)
Daniel Trainer, Alex Taekyung Lee, Sanjoy Sarkar, Vijay Singh, Xinyue Cheng, Naveen K Dandu, Kyaw Zin Latt, Shaoze Wang, Tolulope Michael Ajayi, Sineth Premarathna, David Facemyer, Larry A Curtiss, Sergio E Ulloa, Anh T Ngo, Eric Masson, Saw-Wai Hla
2D Ionic Liquid-Like State of Charged Rare-Earth Clusters on a Metal Surface. Advanced science (Weinheim, Baden-Wurttemberg, Germany) (2024)
Andrew S Lee, Sarah N Elliott, Hassan Harb, Logan Ward, Ian Foster, Larry A Curtiss, Rajeev S Assary
E min : A First-Principles Thermochemical Descriptor for Predicting Molecular Synthesizability. Journal of chemical information and modeling 64 (4) (2024)
Naveen K Dandu, Logan Ward, Rajeev S Assary, Paul C Redfern, Larry A Curtiss
Accurate Prediction of Adiabatic Ionization Potentials of Organic Molecules using Quantum Chemistry Assisted Machine Learning. The journal of physical chemistry. A (2023)
Alireza Kondari, Mohammadreza Esmaeilirad, Ahmad Mosen Harzandi, Rachid Amine, Mahmoud Tamadoni Saray, Lei Yu, Tongchao Liu, Jianguo Wen, Nannan Shan, Hsien-Hau Wang, Anh T Ngo, Paul C Redfern, Christopher S Johnson, Khalil Amine, Reza Shahbazian-Yassar, Larry A Curtiss, Mohammad Asadi
A room temperature rechargeable Li 2 O-based lithium-air battery enabled by a solid electrolyte. Science (New York, N.Y.) 379 (6631) (2023)
Venkateshkumar Prabhakaran, Garvit Agarwal, Jason D Howard, Sungun Wi, Vaithiyalingam Shutthanandan, Dan-Thien Nguyen, Luke Soule, Grant E Johnson, Yi-Sheng Liu, Feipeng Yang, Xuefei Feng, Jinghua Guo, Kie Hankins, Larry A Curtiss, Karl T Mueller, Rajeev S Assary, Vijayakumar Murugesan
Coordination-Dependent Chemical Reactivity of TFSI Anions at a Mg Metal Interface. ACS applied materials & interfaces (2023)
Hsien-Hau Wang, Chengji Zhang, Jing Gao, Kah Chun Lau, Samuel T Plunkett, Moon Park, Rachid Amine, Larry A Curtiss
Template assisted lithium superoxide growth for lithium-oxygen batteries. Faraday discussions (2023)
Venkateshkumar Prabhakaran, Garvit Agarwal, Jason D Howard, Sungun Wi, Vaithiyalingam Shutthanandan, Dan-Thien Nguyen, Luke Soule, Grant E Johnson, Yi-Sheng Liu, Feipeng Yang, Xuefei Feng, Jinghua Guo, Kie Hankins, Larry A Curtiss, Karl T Mueller, Rajeev S Assary, Vijayakumar Murugesan
Coordination-Dependent Chemical Reactivity of TFSI Anions at a Mg Metal Interface. ACS applied materials & interfaces 15 (5) (2023)
Tijana Rajh, Eric Masson, Kyaw Zin Latt, Ashton Smith, Alexander M Brugh, Naveen Dandu, Daniel Trainer, Larry A Curtiss, Anh T Ngo, Saw-Wai Hla
Light- and Chemical-Doping-Induced Magnetic Behavior of Eu Molecular Systems. Inorganic chemistry (2023)
Nannan Shan, Anh T Ngo, Alireza Kondari, Mohammad Asadi, Larry A Curtiss
A solid-state Li-air battery: computational studies of interfaces and relevance to discharge mechanism. Faraday discussions (2023)
Aashutosh N Mistry, Zhou Yu, Brandon L Peters, Chao Fang, Rui Wang, Larry A Curtiss, Nitash P Balsara, Lei Cheng, Venkat Srinivasan
Toward Bottom-Up Understanding of Transport in Concentrated Battery Electrolytes. ACS central science 8 (7) (2022)
Jason D Howard, Guennadi Evmenenko, Jae Jin Kim, Robert E Warburton, Shane Patel, Timothy T Fister, D Bruce Buchholz, Jeffrey P Greeley, Larry A Curtiss, Paul Fenter
Understanding the Solid-State Electrode-Electrolyte Interface of a Model System Using First-Principles Statistical Mechanics and Thin-Film X-ray Characterization. ACS applied materials & interfaces 14 (5) (2022)
Christian P Canlas, Lei Cheng, Brandon O'Neill, Fulya Dogan, Joseph A Libera, James A Dumesic, Larry A Curtiss, Jeffrey W Elam
Tunable Solid Acid Catalyst Thin Films Prepared by Atomic Layer Deposition. ACS applied materials & interfaces 14 (38) (2022)
Sina Rastegar, Alireza Ahmadiparidari, Sachin Kumar Singh, Chengji Zhang, Zahra Hemmat, Naveen K Dandu, Michael J Counihan, Maryam Bagheri, Tomas Rojas, Leily Majidi, Shuxi Wang, Ahmad Jaradat, Rajeev S Assary, Paul C Redfern, Parisa Mirbood, Sanja Tepavcevic, Arunkumar Subramanian, Anh T Ngo, Larry A Curtiss, Amin Salehi-Khojin
A KMnO 4 -Generated Colloidal Electrolyte for Redox Mediation and Anode Protection in a Li-Air Battery. ACS nano 16 (11) (2022)
Naveen K Dandu, Rajeev S Assary, Paul C Redfern, Logan Ward, Ian Foster, Larry A Curtiss
Improving the Accuracy of Composite Methods: A G4MP2 Method with G4-like Accuracy and Implications for Machine Learning. The journal of physical chemistry. A 126 (27) (2022)
Shadi Fuladi, Hamed Gholivand, Alireza Ahmadiparidari, Larry A Curtiss, Amin Salehi-Khojin, Fatemeh Khalili Araghi
Multicomponent Phase Separation in Ternary Mixture Ionic Liquid Electrolytes. The journal of physical chemistry. B 125 (25) (2021)
Logan Ward, Naveen K Dandu, Ben Blaiszik, Badri Narayanan, Rajeev S Assary, Paul C Redfern, Ian Foster, Larry A Curtiss
Graph-Based Approaches for Predicting Solvation Energy in Multiple Solvents: Open Datasets and Machine Learning Models. The journal of physical chemistry. A 125 (27) (2021)
Sina Rastegar, Zahra Hemmat, Chengji Zhang, Samuel Plunkett, Jianguo Wen, Naveen K Dandu, Tomas Rojas, Leily Majidi, Saurabh N Misal, Anh T Ngo, Larry A Curtiss, Amin Salehi-Khojin
High-Rate Long Cycle-Life Li-Air Battery Aided by Bifunctional InX3 (X = I and Br) Redox Mediators. ACS applied materials & interfaces 13 (4) (2021)
Garvit Agarwal, Jason D Howard, Venkateshkumar Prabhakaran, Grant E Johnson, Vijayakumar Murugesan, Karl T Mueller, Larry A Curtiss, Rajeev S Assary
Insights into Spontaneous Solid Electrolyte Interphase Formation at Magnesium Metal Anode Surface from Ab Initio Molecular Dynamics Simulations. ACS applied materials & interfaces 13 (32) (2021)
Yuan Zhang, Daniel J Trainer, Badri Narayanan, Yang Li, Anh T Ngo, Sushila Khadka, Arnab Neogi, Brandon Fisher, Larry A Curtiss, Subramanian K R S Sankaranarayanan, Saw-Wai Hla
One-Dimensional Lateral Force Anisotropy at the Atomic Scale in Sliding Single Molecules on a Surface. Nano letters 21 (15) (2021)
Zhou Yu, Larry A Curtiss, Randall E Winans, Yang Zhang, Tao Li, Lei Cheng
Asymmetric Composition of Ionic Aggregates and the Origin of High Correlated Transference Number in Water-in-Salt Electrolytes. The journal of physical chemistry letters 11 (4) (2020)
Kee Sung Han, Zhou Yu, Hui Wang, Paul C Redfern, Lin Ma, Lei Cheng, Ying Chen, Jian Zhi Hu, Larry A Curtiss, Kang Xu, Vijayakumar Murugesan, Karl T Mueller
Origin of Unusual Acidity and Li+ Diffusivity in a Series of Water-in-Salt Electrolytes. The journal of physical chemistry. B 124 (25) (2020)
Naveen K Dandu, Logan Ward, Rajeev S Assary, Paul C Redfern, Badri Narayanan, Ian T Foster, Larry A Curtiss
Quantum-Chemically Informed Machine Learning: Prediction of Energies of Organic Molecules with 10 to 14 Non-hydrogen Atoms. The journal of physical chemistry. A 124 (28) (2020)
Avik Halder, Anh T Ngo, Xiangyi Luo, Hsien-Hau Wang, Jianguo Wen, Pedram Abbasi, Mohammad Asadi, Chengji Zhang, Dean Miller, Dongzhou Zhang, Jun Lu, Paul C Redfern, Kah Chun Lau, Rachid Amine, Rajeev S Assary, Yun Jung Lee, Amin Salehi-Khojin, Štefan Vajda, Khalil Amine, Larry A Curtiss
In Situ Formed Ir3Li Nanoparticles as Active Cathode Material in Li-Oxygen Batteries. The journal of physical chemistry. A 123 (46) (2019)
Leily Majidi, Poya Yasaei, Robert E Warburton, Shadi Fuladi, John Cavin, Xuan Hu, Zahra Hemmat, Sung Beom Cho, Pedram Abbasi, Márton Vörös, Lei Cheng, Baharak Sayahpour, Igor L Bolotin, Peter Zapol, Jeffrey Greeley, Robert F Klie, Rohan Mishra, Fatemeh Khalili-Araghi, Larry A Curtiss, Amin Salehi-Khojin
New Class of Electrocatalysts Based on 2D Transition Metal Dichalcogenides in Ionic Liquid. Advanced materials (Deerfield Beach, Fla.) 31 (4) (2018)
Cesar Plascencia, Larry A Curtiss, Cong Liu
Hydrogen Activation by Silica-Supported Metal Ion Catalysts: Catalytic Properties of Metals and Performance of DFT Functionals. The journal of physical chemistry. A 123 (1) (2018)
Justin G Connell, Yisi Zhu, Peter Zapol, Sanja Tepavcevic, Asma Sharafi, Jeff Sakamoto, Larry A Curtiss, Dillon D Fong, John W Freeland, Nenad M Markovic
Crystal Orientation-Dependent Reactivity of Oxide Surfaces in Contact with Lithium Metal. ACS applied materials & interfaces 10 (20) (2018)
Anh T Ngo, Timur Skeini, Violeta Iancu, Paul C Redfern, Larry A Curtiss, Saw Wai Hla
Manipulation of Origin of Life Molecules: Recognizing Single-Molecule Conformations in β-Carotene and Chlorophyll-a/β-Carotene Clusters. ACS nano 12 (1) (2018)
Minjeong Shin, Heng-Liang Wu, Badri Narayanan, Kimberly A See, Rajeev S Assary, Lingyang Zhu, Richard T Haasch, Shuo Zhang, Zhengcheng Zhang, Larry A Curtiss, Andrew A Gewirth
Effect of the Hydrofluoroether Cosolvent Structure in Acetonitrile-Based Solvate Electrolytes on the Li+ Solvation Structure and Li-S Battery Performance. ACS applied materials & interfaces 9 (45) (2017)
Zhiyuan Qi, Chaoxian Xiao, Cong Liu, Tian Wei Goh, Lin Zhou, Raghu Maligal-Ganesh, Yuchen Pei, Xinle Li, Larry A Curtiss, Wenyu Huang
Sub-4 nm PtZn Intermetallic Nanoparticles for Enhanced Mass and Specific Activities in Catalytic Electrooxidation Reaction. Journal of the American Chemical Society 139 (13) (2017)
Wei Yu, Kah Chun Lau, Yu Lei, Ruliang Liu, Lei Qin, Wei Yang, Baohua Li, Larry A Curtiss, Dengyun Zhai, Feiyu Kang
Dendrite-Free Potassium-Oxygen Battery Based on a Liquid Alloy Anode. ACS applied materials & interfaces 9 (37) (2017)