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Journal Articles

Analytical model for spin dynamics in radical pairs under the spin-locking condition

T. Yago
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 244701 (2024)
https://doi.org/10.1063/5.0210982
Published: June 2024
View article titled, Analytical model for spin dynamics in radical pairs under the spin-locking condition
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Journal Articles

Limitations and generalizations of the first order kinetics reaction expression for modeling diffusion-driven exchange: Implications on NMR exchange measurements

Alfredo Ordinola, Evren Özarslan, Ruiliang Bai, Magnus Herberthson
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 084701 (2024)
https://doi.org/10.1063/5.0188865
Published: February 2024
View article titled, Limitations and generalizations of the first order kinetics reaction expression for modeling diffusion-driven exchange: Implications on NMR exchange measurements
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Journal Articles

Using deep learning to accelerate magnetic resonance measurements of molecular exchange

Zhaowei Cheng, Songtao Hu, Guangxu Han, Ke Fang, Xinyu Jin, Alfredo Ordinola, Evren Özarslan, Ruiliang Bai
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 054201 (2023)
https://doi.org/10.1063/5.0159343
Published: August 2023
View article titled, Using deep learning to accelerate magnetic resonance measurements of molecular exchange
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Journal Articles

Diffusion within pores fully revealed by magnetic resonance

Evren Özarslan, Cem Yolcu, Alfredo Ordinola, Deneb Boito, Tom Dela Haije, Mathias Højgaard Jensen, Magnus Herberthson
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 161102 (2023)
https://doi.org/10.1063/5.0146304
Published: April 2023
View article titled, Diffusion within pores fully revealed by magnetic resonance
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Includes: Supplementary data
Journal Articles

Isotope study of the nonlinear pressure shifts of 85Rb and 87Rb hyperfine resonances in Ar, Kr, and Xe buffer gases

B. H. McGuyer
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 144304 (2023)
https://doi.org/10.1063/5.0145919
Published: April 2023
View article titled, Isotope study of the nonlinear pressure shifts of <sup>85</sup>Rb and <sup>87</sup>Rb hyperfine resonances in Ar, Kr, and Xe buffer gases
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Includes: Supplementary data
Journal Articles

A modernized view of coherence pathways applied to magnetic resonance experiments in unstable, inhomogeneous fields

Editor’s Pick
Alec A. Beaton, Alexandria Guinness, John M. Franck
Journal: The Journal of Chemical Physics
J. Chem. Phys. 157, 174204 (2022)
https://doi.org/10.1063/5.0105388
Published: November 2022
View article titled, A modernized view of coherence pathways applied to magnetic resonance experiments in unstable, inhomogeneous fields
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Includes: Supplementary data
Journal Articles

Optical readout of singlet fission biexcitons in a heteroacene with photoluminescence detected magnetic resonance

Gajadhar Joshi, Ryan D. Dill, Karl J. Thorley, John E. Anthony, Obadiah G. Reid, Justin C. Johnson
Journal: The Journal of Chemical Physics
J. Chem. Phys. 157, 164702 (2022)
https://doi.org/10.1063/5.0103662
Published: October 2022
View article titled, Optical readout of singlet fission biexcitons in a heteroacene with photoluminescence detected magnetic resonance
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Includes: Supplementary data
Journal Articles

Paramagnetic probes in an organic semiconductor: μSR and DFT calculations of the Mu adducts of Alq3 and 8-hydroxyquinoline

Iain McKenzie, Joseph Cannon, Danaan Cordoni-Jordan, Brian P. Mulley, Robert Scheuermann
Journal: The Journal of Chemical Physics
J. Chem. Phys. 157, 064702 (2022)
https://doi.org/10.1063/5.0105200
Published: August 2022
View article titled, Paramagnetic probes in an organic semiconductor: <em>μ</em>SR and DFT calculations of the Mu adducts of Alq<sub>3</sub> and 8-hydroxyquinoline
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Includes: Supplementary data
Journal Articles

A unified description for polarization-transfer mechanisms in magnetic resonance in static solids: Cross polarization and DNP

Zhenfeng Pang, Sheetal Jain, Chen Yang, Xueqian Kong, Kong Ooi Tan
Journal: The Journal of Chemical Physics
J. Chem. Phys. 156, 244109 (2022)
https://doi.org/10.1063/5.0092265
Published: June 2022
View article titled, A unified description for polarization-transfer mechanisms in magnetic resonance in static solids: Cross polarization and DNP
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Includes: Supplementary data
Journal Articles

Chirped ordered pulses for ultra-broadband ESR spectroscopy

Jean-Baptiste Verstraete, William K. Myers, Mohammadali Foroozandeh
Journal: The Journal of Chemical Physics
J. Chem. Phys. 154, 094201 (2021)
https://doi.org/10.1063/5.0038511
Published: March 2021
View article titled, Chirped ordered pulses for ultra-broadband ESR spectroscopy
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Includes: Supplementary data
Journal Articles

Electric field effect on 31P NMR magnetic shielding

Ilya G. Shenderovich
Journal: The Journal of Chemical Physics
J. Chem. Phys. 153, 184501 (2020)
https://doi.org/10.1063/5.0031167
Published: November 2020
View article titled, Electric field effect on <sup>31</sup>P NMR magnetic shielding
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Includes: Supplementary data
Journal Articles

Statistical learning of NMR tensors from 2D isotropic/anisotropic correlation nuclear magnetic resonance spectra

Deepansh J. Srivastava, Philip J. Grandinetti
Journal: The Journal of Chemical Physics
J. Chem. Phys. 153, 134201 (2020)
https://doi.org/10.1063/5.0023345
Published: October 2020
View article titled, Statistical learning of NMR tensors from 2D isotropic/anisotropic correlation nuclear magnetic resonance spectra
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Includes: Supplementary data
Journal Articles

Systematic differences in the relaxation stretching of polar molecular liquids probed by dielectric vs magnetic resonance and photon correlation spectroscopy

Editor’s Pick
Thomas Körber, Robert Stäglich, Catalin Gainaru, Roland Böhmer, Ernst A. Rössler
Journal: The Journal of Chemical Physics
J. Chem. Phys. 153, 124510 (2020)
https://doi.org/10.1063/5.0022155
Published: September 2020
View article titled, Systematic differences in the relaxation stretching of polar molecular liquids probed by dielectric vs magnetic resonance and photon correlation spectroscopy
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Journal Articles

On the equivalence between different averaging schemes in magnetic resonance

Shreyan Ganguly, Rajat Garg, Ramesh Ramachandran
Journal: The Journal of Chemical Physics
J. Chem. Phys. 153, 094103 (2020)
https://doi.org/10.1063/5.0018753
Published: September 2020
View article titled, On the equivalence between different averaging schemes in magnetic resonance
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Includes: Supplementary data
Journal Articles

Computational prediction of muon stopping sites: A novel take on the unperturbed electrostatic potential method

Simone Sturniolo, Leandro Liborio
Journal: The Journal of Chemical Physics
J. Chem. Phys. 153, 044111 (2020)
https://doi.org/10.1063/5.0012381
Published: July 2020
View article titled, Computational prediction of muon stopping sites: A novel take on the unperturbed electrostatic potential method
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Includes: Supplementary data
Journal Articles

Theory of coherent averaging in magnetic resonance using effective Hamiltonians

Rajat Garg, Ramesh Ramachandran
Journal: The Journal of Chemical Physics
J. Chem. Phys. 153, 034106 (2020)
https://doi.org/10.1063/5.0012892
Published: July 2020
View article titled, Theory of coherent averaging in magnetic resonance using effective Hamiltonians
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Includes: Supplementary data
Journal Articles

Variations of paramagnetic defects and dopants in geo-MoS2 from diverse localities probed by ESR

A. Stesmans, B. Schoenaers, V. V. Afanas’ev
Journal: The Journal of Chemical Physics
J. Chem. Phys. 152, 234702 (2020)
https://doi.org/10.1063/5.0002046
Published: June 2020
View article titled, Variations of paramagnetic defects and dopants in geo-MoS<sub>2</sub> from diverse localities probed by ESR
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Journal Articles

Microsecond dynamics in proteins by two-dimensional ESR: Predictions

Pranav Gupta, Zhichun Liang, Jack H. Freed
Journal: The Journal of Chemical Physics
J. Chem. Phys. 152, 214112 (2020)
https://doi.org/10.1063/5.0008094
Published: June 2020
View article titled, Microsecond dynamics in proteins by two-dimensional ESR: Predictions
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Includes: Supplementary data
Journal Articles

Fast destruction of singlet order in NMR experiments

Bogdan A. Rodin, Kirill F. Sheberstov, Alexey S. Kiryutin, Lynda J. Brown, Richard C. D. Brown, Mohamed Sabba, Malcolm H. Levitt, Alexandra V. Yurkovskaya, Konstantin L. Ivanov
Journal: The Journal of Chemical Physics
J. Chem. Phys. 151, 234203 (2019)
https://doi.org/10.1063/1.5131730
Published: December 2019
View article titled, Fast destruction of singlet order in NMR experiments
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Includes: Supplementary data
Journal Articles

Low magnetic field effects on triplet pair annihilations at canonical orientations

T. Yago
Journal: The Journal of Chemical Physics
J. Chem. Phys. 151, 214501 (2019)
https://doi.org/10.1063/1.5127904
Published: December 2019
View article titled, Low magnetic field effects on triplet pair annihilations at canonical orientations
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