Closed-Loop Electrolyte Design for Lithium-Mediated Ammonia Synthesis

Nitrogen reduction to ammonia at high efficiency and rates based on a phosphonium proton shuttle

(2021) Bryan H. R. Suryanto et al.   SCIENCE

A Combined Theory‐Experiment Analysis of the Surface Species in Lithium‐Mediated NH 3 Electrosynthesis

(2020) Jay A. Schwalbe et al.   ChemElectroChem

A Study of Kamlet–Taft β and π* Scales of Solvent Basicity and Polarity/Polarizability Using Computationally Derived Molecular Properties

(2020) W. Earle Waghorne   JOURNAL OF SOLUTION CHEMISTRY

Rational Catalyst Design for N2 Reduction under Ambient Conditions: Strategies towards Enhanced Conversion Efficiency

(2020) Lei Shi et al.   ACS Catalysis

Critical Assessment of the Electrocatalytic Activity of Vanadium and Niobium Nitrides toward Dinitrogen Reduction to Ammonia

(2019) Hoang-Long Du et al.   ACS Sustainable Chemistry & Engineering

A rigorous electrochemical ammonia synthesis protocol with quantitative isotope measurements

(2019) Suzanne Z. Andersen et al.   NATURE

Electrochemical Dinitrogen Reduction to Ammonia by Mo2N: Catalysis or Decomposition?

(2019) Bo Hu et al.   ACS Energy Letters

A Method of Calculating the Kamlet–Abboud–Taft Solvatochromic Parameters Using COSMO-RS

(2019) James Sherwood et al.   MOLECULES

Strategies Toward Selective Electrochemical Ammonia Synthesis

(2019) Aayush R. Singh et al.   ACS Catalysis

Role for Standardization in Electrocatalytic Ammonia Synthesis: A Conversation with Leo Liu, Lauren Greenlee, and Douglas MacFarlane

(2019) Christina MacLaughlin   ACS Energy Letters

Electrochemical synthesis of ammonia as a potential alternative to the Haber–Bosch process

(2019) Grigorii Soloveichik   Nature Catalysis

Establishing Predictive Models for Solvatochromic Parameters of Ionic Liquids

(2019) Vishwesh Venkatraman et al.   Frontiers in Chemistry

MoleculeNet: a benchmark for molecular machine learning

(2018) Zhenqin Wu et al.   Chemical Science

The Use of Controls for Consistent and Accurate Measurements of Electrocatalytic Ammonia Synthesis from Dinitrogen

(2018) Lauren F. Greenlee et al.   ACS Catalysis

Accelerated discovery of metallic glasses through iteration of machine learning and high-throughput experiments

(2018) Fang Ren et al.   Science Advances

Predictions of new ABO3 perovskite compounds by combining machine learning and density functional theory

(2018) Prasanna V. Balachandran et al.   PHYSICAL REVIEW MATERIALS

A machine learning approach for engineering bulk metallic glass alloys

(2018) Logan Ward et al.   ACTA MATERIALIA

Review of electrical energy storage technologies, materials and systems: challenges and prospects for large-scale grid storage

(2018) Turgut M. Gür   Energy & Environmental Science

Electrochemical Ammonia Synthesis and Ammonia Fuel Cells

(2018) Feng Jiao et al.   ADVANCED MATERIALS

Quantifying robustness of DFT predicted pathways and activity determining elementary steps for electrochemical reactions

(2018) Dilip Krishnamurthy et al.   JOURNAL OF CHEMICAL PHYSICS

Ammonia synthesis from N2 and H2O using a lithium cycling electrification strategy at atmospheric pressure

(2017) Joshua M. McEnaney et al.   Energy & Environmental Science

Ammonia as a Renewable Energy Transportation Media

(2017) S. Giddey et al.   ACS Sustainable Chemistry & Engineering

Reversible Nitrogen Fixation Based on a Rechargeable Lithium-Nitrogen Battery for Energy Storage

(2017) Jin-Ling Ma et al.   Chem

Molecular graph convolutions: moving beyond fingerprints

(2016) Steven Kearnes et al.   JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

A general-purpose machine learning framework for predicting properties of inorganic materials

(2016) Logan Ward et al.   npj Computational Materials

The Contamination of Commercial 15N2 Gas Stocks with 15N–Labeled Nitrate and Ammonium and Consequences for Nitrogen Fixation Measurements

(2014) Richard Dabundo et al.   PLoS One

Liquid fuel cells

(2014) Grigorii L Soloveichik   Beilstein Journal of Nanotechnology

Understanding the polarity of ionic liquids

(2011) M. A. Ab Rani et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

How a century of ammonia synthesis changed the world

(2008) Jan Willem Erisman et al.   Nature Geoscience