Publications

Lithium Transference in Electrolytes with Star-Shaped Multivalent Anions Measured by Electrophoretic NMR
Chakraborty, S.*; Halat, D. M.*; Im, J.; Hickson, D. T.; Reimer, J. A.; Balsara, N. P.. PCCP 25, 21065 (2023) * equal contribution [DOI]

Quantifying Selective Solvent Transport under an Electric Field in Mixed-Solvent Electrolytes
Fang, C.; Halat, D. M.; Mistry, A.; Reimer, J. A.; Balsara, N. P.; Wang, R.. Chem. Sci. 14, 5332 (2023) [DOI]

Ion Correlation and Negative Lithium Transference in Polyelectrolyte Solutions
Bergstrom, H. K.; Fong, K. D.; Halat, D. M.; Karouta, C. A.; Celik, H. C.; Reimer, J. A.; McCloskey, B. D.. Chem. Sci. 14, 6546 (2023) [DOI]

Transference Number of Electrolytes from the Velocity of a Single Species Measured by Electrophoretic NMR
Halat, D. M.; Mistry, A.; Hickson, D. T.; Srinivasan, V.; Balsara, N. P.; Reimer, J. A.. J. Electrochem. Soc. 170, 030535 (2023) [DOI]

Zn-Ion Transporting, In Situ Formed Robust Solid Electrolyte Interphase for Extremely Stable Zinc Metal Anodes over a Wide-Temperature Range
Xiong, P.; Kang, Y.; Yao, N.; Chen, X.; Mao, H.; Jang, W.-S.; Halat, D. M.; Fu, Z.-H.; Zeng, L.; Dou, Q.; Han, X.; Harpalsinh, R.; Tian, Z.; Park, J. H.; Jung, M.-H.; Jeong, H. Y.; Kim, Y.-M.; Reimer, J. A.; Zhang, Q.; Park, H. S.. ACS Energy Lett. 8, 1613 (2023) [DOI]

Dynamic Heterogeneity of Solvent Motion and Ion Transport in Concentrated Electrolytes
Fang, C.; Halat, D. M.; Balsara, N. P.; Wang, R.. J. Phys. Chem. B. 127, 1803 (2023) [DOI]

An Ordered, Self-Assembled Nanocomposite with Efficient Electronic and Ionic Transport
Quill, T. J.; LeCroy, G.; Halat, D. M.; Sheelamanthula, R.; Marks, A.; Grundy, L. S.; McCulloch, I.; Reimer, J. A.; Balsara, N. P.; Giovannitti, A.; Salleo, A.; Takacs, C. J.. Nat. Mater. 22, 362 (2023) [DOI]

Double Paddle-Wheel Enhanced Sodium Ion Conduction in an Antiperovskite Solid Electrolyte
Double Paddle-Wheel Enhanced Sodium Ion Conduction in an Antiperovskite Solid ElectrolyteTsai, P.-C.; Mair, S.; Smith, J.; Halat, D. M.; Chien, P.-H.; Kim, K.; Zhang, D.; Li, Y.; Yin, L.; Liu, J.; Lapidus, S. H.; Reimer, J. A.; Balsara, N. P.; Siegel, D. J.; Chiang, Y.-M.. Adv. Energy Mater. 13, 2203284 (2022) [DOI]

Effect of Solvent Motion on Ion Transport in Electrolytes
Mistry, A.; Grundy, L. S.; Halat, D. M.; Newman, J.; Balsara, N. P.; Srinivasan, V.. J. Electrochem. Soc. 169, 040524 (2022) [DOI]

Understanding Solvation Structure of Li-Ion Battery Electrolytes Using DFT-Based Computation and ¹H NMR Spectroscopy
Im, J.;† Halat, D. M.; Fang, C.; Hickson, D. T.; Wang, R.; Balsara, N. P.; Reimer, J. A.. J. Phys. Chem. B. 126, 9893 (2022) †First-year undergraduate mentee [DOI]

The Transference Number
Gao, K. W.; Fang, C.; Halat, D. M.; Mistry, A.; Newman, J.; Balsara, N. P.. Energy Environ. Mater. 5, 366–369 (2022) [DOI]

Understanding the Impact of Multi-Chain Ion Coordination in Poly(Ether-Acetal) Electrolytes
Understanding the Impact of Multi-Chain Ion Coordination in Poly(Ether-Acetal) ElectrolytesSundararaman, S.; Halat, D. M.; Reimer, J. A.; Balsara, N. P.; Prendergast, D.. Macromolecules 55, 9880 (2022) [DOI]

Complete Characterization of a Lithium Battery Electrolyte Using a Combination of Electrophoretic NMR and Electrochemical Methods
Hickson, D.; Halat, D. M.; Ho, A. S.; Reimer, J. A.; Balsara, N. P.. Phys. Chem. Chem. Phys. 24, 26591 (2022) [DOI]

A Scalable Solid-State Nanoporous Network with Atomic-Level Interaction Design for Carbon Dioxide Capture
Mao, H.; Tang, J.; Day, G. S.; Peng, Y.; Wang, H.; Xiao, X.; Yang, Y.; Jiang, Y.; Chen, S.; Halat, D. M.; Lund, A.; Lv, X.; Zhang, W.; Yang, C.; Lin, Z.; Zhou, H.-C.; Pines, A.; Cui, Y.; Reimer, J. A.. Sci. Adv. 8, eabo6849 (2022) [DOI]

Electric-Field-Induced Spatially Dynamic Heterogeneity of Solvent Motion and Cation Transference in Electrolytes
Halat, D. M.; Fang, C.; Hickson, D.; Mistry, A.; Reimer, J. A.; Balsara, N. P.; Wang, R.. Phys. Rev. Lett. 128, 198002 (2022) [DOI]

Exploring the Ion Solvation Environments in Solid-State Polymer Electrolytes through Free-Energy Sampling
Sundararaman, S.; Halat, D. M.; Choo, Y.; Snyder, R. L.; Abel, B. A.; Coates, G. W.; Reimer, J. A.; Balsara, N. P.; Prendergast, D.. Macromolecules 54, 8590–8600 (2021) [DOI]

Endogenous 17O Dynamic Nuclear Polarization of Gd-Doped CeO2 from 100 to 370 K
Hope, M. A.; Björgvinsdóttir, S.; Halat, D. M.; Menzildjian, G.; Wang, Z.; Zhang, B.; MacManus-Driscoll, J. L.; Lesage, A.; Lelli, M.; Emsley, L.; Grey, C. P. Endogenous. J. Phys. Chem. C 125, 18799–18809 (2021) [DOI]

Modifying Li+ and Anion Diffusivities in Polyacetal Electrolytes: A Pulsed-Field-Gradient NMR Study of Ion Self-Diffusion
Halat, D. M.; Snyder, R. L.; Sundararaman, S.; Choo, Y.; Gao, K. W.; Hoffman, Z. J.; Abel, B. A.; Grundy, L. S.; Galluzzo, M. D.; Gordon, M. P.; Celik, H.; Urban, J. J.; Prendergast, D.; Coates, G. W.; Balsara, N. P.; Reimer, J. A.. Chem. Mater. 33, 4915–4926 (2021) [DOI]

Improved Li+ Transport in Polyacetal Electrolytes: Conductivity and Current Fraction in a Series of Polymers
Snyder, R. L.; Choo, Y.; Gao, K. W.; Halat, D. M.; Abel, B. A.; Sundararaman, S.; Prendergast, D.; Reimer, J. A.; Balsara, N. P.; Coates, G. W.. ACS Energy Lett. 6, 1886–1891 (2021) [DOI]

Revealing Molecular Mechanisms in Hierarchical Nanoporous Carbon via Nuclear Magnetic Resonance
Mao, H.; Tang, J.; Xu, J.; Peng, Y.; Chen, J.; Wu, B.; Jiang, Y.; Hou, K.; Chen, S.; Wang, J.; Lee, H. R.; Halat, D. M.; Zhang, B.; Chen, W.; Plantz, A. Z.; Lu, Z.; Cui, Y.; Reimer, J. A.. Matter 3, 2093–2107 (2020) [DOI]

Designing hierarchical nanoporous membranes for highly efficient gas adsorption and storage
Mao, H.; Tang, J.; Chen, J.; Wan, J.; Hou, K.; Peng, Y.; Halat, D. M.; Xiao, L.; Zhang, R.; Lv, X.; Yang, A.; Cui, Y.; Reimer, J. A.. Sci. Adv. 6, eabb0694 (2020) [DOI]

Revealing the Structure and Oxygen Transport at Interfaces in Complex Oxide Heterostructures via 17O NMR Spectroscopy
Hope, M. A.; Zhang, B.; Zhu, B.; Halat, D. M.; MacManus-Driscoll, J. L.; Grey, C. P.. Chem. Mater. 32, 7921–7931 (2020) [DOI]

Selective, High-Temperature O₂ Adsorption in Chemically Reduced, Redox-Active Iron-Pyrazolate Metal–Organic Frameworks
Jaffe, A.; Ziebel, M. E.; Halat, D. M.; Biggins, N.; Murphy, R. A.; Chakarawet, K.; Reimer, J. A.; Long, J. R.. J. Am. Chem. Soc. 142, 14627–14637 (2020) [DOI]

Interactions of Oxide Surfaces with Water Revealed with Solid-State NMR Spectroscopy
Chen, J.; Hope, M. A.; Lin, Z.; Wang, M.; Liu, T.; Halat, D. M.; Wen, Y.; Chen, T.; Ke, X.; Magusin, P. C. M. M.; Ding, W.; Xia, X.; Wu, X-P.; Gong, X-Q.; Grey, C. P.; Peng, L.. J. Am. Chem. Soc. 142, 11173–11182 (2020) [DOI]

Cesium Substitution Disrupts Concerted Cation Dynamics in Formamidinium Hybrid Perovskites
Mozur, E. M.; Hope, M. A.; Trowbridge, J.; Halat, D. M.; Daemen, L. L.; Maughan, A. E.; Prisk, T. R.; Grey, C. P.; Neilson, J. R.. Chem. Mater 32, 6266–6277 (2020) [DOI]

Diffusion and Migration in Polymer Electrolytes
Choo, Y.; Halat, D. M.; Villaluenga, I.; Balsara, N. P.. Prog. Polym. Sci. 103, 101220 (2020) [DOI]

Evolution of lithium ordering with (de)-lithiation in β-LiVOPO4 : insights through solid state NMR and first principles DFT calculations
Britto, S.; Seymour, I. D.; Halat, D. M.; Hidalgo, M. F. V.; Siu, C.; Reeves, P. J.; Zhou, H.; Chernova, N. A.; Whittingham, M. S.; Grey, C. P.. J. Mater. Chem. A 8, 5546–5557 (2020) [DOI]

Polar Surface Structure of Oxide Nanocrystals Revealed with Solid-State NMR Spectroscopy
Chen, J.; Wu, X-P.; Hope, M. A.; Qian, K.; Halat, D. M.; Liu, T.; Jin, Y.; Zhao, E. W.; Li, Y.; Shen, L.; Ke, X.; Wen, Y.; Du, J-H.; Magusin, P. C. M. M.; Paul, S.; Yu, G.; Ding, W.; Gong, X-Q.; Grey, C. P.; Peng, L.. Nat. Comm. 10, 1–10 (2019) [DOI]

Surface Chemistry Dependence on Aluminum Doping in Ni-Rich LiNi0.8Co0.2−yAlyO2 Cathodes
Lebens-Higgins, Z. W.; Halat, D. M.; Faenza, N. V.; Wahila, M. J.; Mascheck, M.; Wiell, T.; Eriksson, S. K.; Palmgren, P.; Rodriguez, J.; Badway, F.; et al.. Sci. Rep. 304:20:00 (2019) [DOI]

Natural abundance solid-state 33S NMR study of NbS3: applications for battery conversion electrodes
Halat, D. M.; Britto, S.; Griffith, K. J.; Jónsson, E.; Grey, C. P.. ChemComm 55, 12687–12690 (2019) [DOI]

17O Paramagnetic NMR Study of Sm2O3, Eu2O3, and Sm/Eu-substituted CeO2
Hope, M. A.; Halat, D. M.; Lee, J.; Grey, C. P. A. Sol. State Nucl. Magn. Reson. 102, 21–30 (2019) [DOI]

Dissolution of Lithium Metal in Poly(ethylene oxide)
Galluzzo, M. D.; Halat, D. M.; Loo, W. S.; Mullin, S. A.; Reimer, J. A.; Balsara, N. P.. ACS Energy Lett. 4, 903–907 (2019) [DOI]

Variable-temperature multinuclear solid-state NMR study of oxide ion dynamics in fluorite-type bismuth vanadates and phosphates
Dunstan, M. T.*; Halat, D. M.*; Tate, M. L.; Evans, I. R.; Grey, C. P.. Chem. Mater. 31, 1704–1714 (2019) *equal contribution [DOI]

The Phase Evolution and Degradation Modes of R-3m LixNi1-y-zCoyAlzO2 Electrodes Cycled Near Complete Delithiation
Faenza, N. V.; Pereira, N.; Halat, D. M.; Vinckeviciute, J.; Bruce, L.; Radin, M. D.; Mukherjee, P.; Badway, F.; Halajko, A.; Cosandey, F.; Grey, C. P.; Van der Ven, A.; Amatucci, G. G.. Chem. Mater. 30, 7545–7574 (2018) [DOI]

Mixed X-Site Formate–Hypophosphite Hybrid Perovskites.
Wu, Y.; Halat, D. M.; Wei, F.; Binford, T.; Seymour, I. D.; Gaultois, M. W.; Shaker, S.; Wang, J.; Grey, C. P.; Cheetham, A. K.. Chem. Eur. J. 24, 11309–11313 (2018) [DOI]

Study of Defect Chemistry in the System La2-xSrxNiO4+δ by 17O Solid-State NMR Spectroscopy and Ni K-Edge XANES
Halat, D. M.; Dunstan, M. T.; Gaultois, M. W.; Grey, C. P.. Chem. Mater. 30, 4556–4570 (2018) [DOI]

Evolution of the Electrode–Electrolyte Interface of LiNi0.8Co0.15Al0.05O2 Electrodes Due to Electrochemical and Thermal Stress
Lebens-Higgins, Z. W.; Sallis, S.; Faenza, N. V.; Badway, F.; Pereira, N.; Halat, D. M.; Wahila, M.; Schlueter, C.; Lee, T.-L.; Yang, W.; Grey, C. P.; Amatucci, G. G.; Piper, L. F. J.. Chem. Mater. 30, 958–969 (2018) [DOI]

Revealing Local Dynamics of the Protonic Conductor CsH(PO3H) by Solid-State NMR Spectroscopy and First-Principles Calculations
Kim, G.; Griffin, J. M.; Blanc, F.; Halat, D. M.; Haile, S. M.; Grey, C. P.. J. Phys. Chem. C 121, 27830–27838 (2017) [DOI]

Surface-selective direct 17O DNP NMR of CeO2 nanoparticles
Hope, M. A.; Halat, D. M.; Magusin, P. C. M. M.; Paul, S.; Peng, L.; Grey, C. P.. ChemComm 53, 2142–2145 (2017) [DOI]

Enhanced efficiency of solid-state NMR investigations of energy materials using an external automatic tuning/matching (eATM) robot
Pecher, O.*; Halat, D. M.*; Lee, J.; Liu, Z.; Griffith, K. J.; Braun, M.; Grey, C. P.. J. Magn. Reson. 275, 127–136 (2017) *equal contribution [DOI]

Probing Oxide-Ion Mobility in the Mixed Ionic–Electronic Conductor La2NiO4+δ by Solid-State 17O MAS NMR Spectroscopy
Halat, D. M.; Dervişoğlu, R.; Kim, G.; Dunstan, M. T.; Blanc, F.; Middlemiss, D. S.; Grey, C. P.. J. Am. Chem. Soc. 138, 11958–11969 (2016) [DOI]

Characterizing Oxygen Local Environments in Paramagnetic Battery Materials via 17O NMR and DFT Calculations
Seymour, I. D.; Middlemiss, D. S.; Halat, D. M.; Trease, N. M.; Pell, A. J.; Grey, C. P.. J. Am. Chem. Soc. 138, 9405–9408 (2016) [DOI]

In Situ Optical and Electrochemical Studies of SOFC Carbon Tolerance
Reeping, K. W.; Halat, D. M.; Kirtley, J. D.; McIntyre, M. D.; Walker, R. A.. ECS Trans. 61, 57–63 (2014) [DOI]

In Situ Spectroscopic Studies of Carbon Formation in SOFCs Operating with Syn-gas
McIntyre, M. D.; Kirtley, J. D.; Halat, D. M.; Reeping, K. W.; Walker, R. A.. ECS Trans. 57, 1267–1275 (2013) [DOI]

Insights into SOFC Ni/YSZ Anode Degradation Using In-Situ Spectrochronopotentiometry
Kirtley, J. D.; McIntyre, M. D.; Halat, D. M.; Walker, R. A.. ECS Trans. 50, 3–15 (2013) [DOI]

In Situ Raman Studies of Carbon Removal from High Temperature Ni–YSZ Cermet Anodes by Gas Phase Reforming Agents
Kirtley, J.; Singh, A.; Halat, D. M.; Oswell, T.; Hill, J. M.; Walker, R. A.. J. Phys. Chem. C 117, 25908–25916 (2013) [DOI]

High-Temperature ‘Spectrochronopotentiometry’: Correlating Electrochemical Performance withInSitu Raman Spectroscopy in Solid Oxide Fuel Cells
Kirtley, J. D.; Halat, D. M.; McIntyre, M. D.; Eigenbrodt, B. C.; Walker, R. A.. Anal. Chem. 84, 9745–9753 (2012) [DOI]