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Journal Articles

NEXAFS spectroscopy of alkylated benzothienobenzothiophene thin films at the carbon and sulfur K-edges

Open Access
Paul Alexander Chantler, Lars Thomsen, Subhayan Roychoudhury, Chris J. Glover, Valerie Mitchell, Sarah K. M. McGregor, Shih-Chun Lo, Ebinazar B. Namdas, David Prendergast, Christopher R. McNeill
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 184308 (2024)
https://doi.org/10.1063/5.0231117
Published: November 2024
View articletitled, NEXAFS spectroscopy of alkylated benzothienobenzothiophene thin films at the carbon and sulfur K-edges
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Journal Articles

Conical intersection and coherent vibrational dynamics in alkyl iodides captured by attosecond transient absorption spectroscopy

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Kristina F. Chang, Han Wang, Sonia M. Poullain, Jesús González-Vázquez, Luis Bañares, David Prendergast, Daniel M. Neumark, Stephen R. Leone
Journal: The Journal of Chemical Physics
J. Chem. Phys. 156, 114304 (2022)
https://doi.org/10.1063/5.0086775
Published: March 2022
View articletitled, Conical intersection and coherent vibrational dynamics in alkyl iodides captured by attosecond transient absorption spectroscopy
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Includes: Supplementary data
Journal Articles

Mapping wave packet bifurcation at a conical intersection in CH3I by attosecond XUV transient absorption spectroscopy

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Kristina F. Chang, Han Wang, Sonia M. Poullain, David Prendergast, Daniel M. Neumark, Stephen R. Leone
Journal: The Journal of Chemical Physics
J. Chem. Phys. 154, 234301 (2021)
https://doi.org/10.1063/5.0056299
Published: June 2021
View articletitled, Mapping wave packet bifurcation at a conical intersection in CH3I by attosecond XUV transient absorption spectroscopy
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Includes: Supplementary data
Journal Articles

Electronic structure modulation of MoS2 by substitutional Se incorporation and interfacial MoO3 hybridization: Implications of Fermi engineering for electrocatalytic hydrogen evolution and oxygen evolution

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Abhishek Parija, Wasif Zaheer, Junsang Cho, Theodore E. G. Alivio, Sirine C. Fakra, Mohammed Al-Hashimi, David Prendergast, Sarbajit Banerjee
Journal: Chemical Physics Reviews
Chem. Phys. Rev. 2, 011401 (2021)
https://doi.org/10.1063/5.0037749
Published: March 2021
View articletitled, Electronic structure modulation of MoS2 by substitutional Se incorporation and interfacial MoO3 hybridization: Implications of Fermi engineering for electrocatalytic hydrogen evolution and oxygen evolution
Open the PDF for Electronic structure modulation of MoS2 by substitutional Se incorporation and interfacial MoO3 hybridization: Implications of Fermi engineering for electrocatalytic hydrogen evolution and oxygen evolution in another window
Includes: Supplementary data
Journal Articles

Addressing the sensitivity of signals from solid/liquid ambient pressure XPS (APXPS) measurement

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Jin Qian, Artem Baskin, Zhi Liu, David Prendergast, Ethan J. Crumlin
Journal: The Journal of Chemical Physics
J. Chem. Phys. 153, 044709 (2020)
https://doi.org/10.1063/5.0006242
Published: July 2020
View articletitled, Addressing the sensitivity of signals from solid/liquid ambient pressure XPS (APXPS) measurement
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Journal Articles

Probing ultrafast C–Br bond fission in the UV photochemistry of bromoform with core-to-valence transient absorption spectroscopy

Open Access
Benjamin W. Toulson, Mario Borgwardt, Han Wang, Florian Lackner, Adam S. Chatterley, C. D. Pemmaraju, Daniel M. Neumark, Stephen R. Leone, David Prendergast, Oliver Gessner
Journal: Structural Dynamics
Struct. Dyn. 6, 054304 (2019)
https://doi.org/10.1063/1.5113798
Published: October 2019
View articletitled, Probing ultrafast C–Br bond fission in the UV photochemistry of bromoform with core-to-valence transient absorption spectroscopy
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Includes: Supplementary data
Journal Articles

A combined multi-reference pump-probe simulation method with application to XUV signatures of ultrafast methyl iodide photodissociation

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Han Wang, Michael Odelius, David Prendergast
Journal: The Journal of Chemical Physics
J. Chem. Phys. 151, 124106 (2019)
https://doi.org/10.1063/1.5116816
Published: September 2019
View articletitled, A combined multi-reference pump-probe simulation method with application to XUV signatures of ultrafast methyl iodide photodissociation
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Includes: Supplementary data
Journal Articles

Direct observation of delithiation as the origin of analog memristance in LixNbO2

Open Access
Sebastian A. Howard, Christopher N. Singh, Galo J. Paez, Matthew J. Wahila, Linda W. Wangoh, Shawn Sallis, Keith Tirpak, Yufeng Liang, David Prendergast, Mateusz Zuba, Jatinkumar Rana, Alex Weidenbach, Timothy M. McCrone, Wanli Yang, Tien-Lin Lee, Fanny Rodolakis, William Doolittle, Wei-Cheng Lee, Louis F. J. Piper
Journal: APL Materials
APL Mater. 7, 071103 (2019)
https://doi.org/10.1063/1.5108525
Published: July 2019
View articletitled, Direct observation of delithiation as the origin of analog memristance in LixNbO2
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Includes: Supplementary data
Journal Articles

The purported square ice in bilayer graphene is a nanoscale, monolayer object

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Tod A. Pascal, Craig P. Schwartz, Keith V. Lawler, David Prendergast
Journal: The Journal of Chemical Physics
J. Chem. Phys. 150, 231101 (2019)
https://doi.org/10.1063/1.5109468
Published: June 2019
View articletitled, The purported square ice in bilayer graphene is a nanoscale, monolayer object
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Includes: Supplementary data
Journal Articles

Understanding the effect of thionation on naphthalene diimide using first-principles predictions of near-edge x-ray absorption fine structure spectra

Free
Kira Rundel, Yufeng Liang, Adam Welford, David Prendergast, Christopher R. McNeill
Journal: The Journal of Chemical Physics
J. Chem. Phys. 150, 104302 (2019)
https://doi.org/10.1063/1.5084754
Published: March 2019
View articletitled, Understanding the effect of thionation on naphthalene diimide using first-principles predictions of near-edge x-ray absorption fine structure spectra
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Includes: Supplementary data
Journal Articles

Exploring chemical speciation at electrified interfaces using detailed continuum models

Free
Artem Baskin, David Prendergast
Journal: The Journal of Chemical Physics
J. Chem. Phys. 150, 041725 (2019)
https://doi.org/10.1063/1.5058159
Published: January 2019
View articletitled, Exploring chemical speciation at electrified interfaces using detailed continuum models
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Journal Articles

Probing the electric field-induced doping mechanism in YBa2Cu3O7 using computed Cu K-edge x-ray absorption spectra

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Roberta Poloni, A. Lorenzo Mariano, David Prendergast, Javier Garcia-Barriocanal
Journal: The Journal of Chemical Physics
J. Chem. Phys. 149, 234706 (2018)
https://doi.org/10.1063/1.5055283
Published: December 2018
View articletitled, Probing the electric field-induced doping mechanism in YBa2Cu3O7 using computed Cu K-edge x-ray absorption spectra
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Journal Articles

Erratum: “Electrokinetic detection for x-ray spectra of weakly interacting liquids: n-decane and n-nonane” [J. Chem. Phys. 140, 234202 (2014)]

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Royce K. Lam, Orion Shih, Jacob W. Smith, Alex T. Sheardy, Anthony M. Rizzuto, David Prendergast, Richard J. Saykally
Journal: The Journal of Chemical Physics
J. Chem. Phys. 146, 249902 (2017)
https://doi.org/10.1063/1.4990053
Published: June 2017
View articletitled, Erratum: “Electrokinetic detection for x-ray spectra of weakly interacting liquids: n-decane and n-nonane” [J. Chem. Phys. 140, 234202 (2014)]
Open the PDF for Erratum: “Electrokinetic detection for x-ray spectra of weakly interacting liquids: n-decane and n-nonane” [J. Chem. Phys. 140, 234202 (2014)] in another window
Journal Articles

Ultrafast carrier thermalization and trapping in silicon-germanium alloy probed by extreme ultraviolet transient absorption spectroscopy

Open Access
Michael Zürch, Hung-Tzu Chang, Peter M. Kraus, Scott K. Cushing, Lauren J. Borja, Andrey Gandman, Christopher J. Kaplan, Myoung Hwan Oh, James S. Prell, David Prendergast, Chaitanya D. Pemmaraju, Daniel M. Neumark, Stephen R. Leone
Journal: Structural Dynamics
Struct. Dyn. 4, 044029 (2017)
https://doi.org/10.1063/1.4985056
Published: June 2017
View articletitled, Ultrafast carrier thermalization and trapping in silicon-germanium alloy probed by extreme ultraviolet transient absorption spectroscopy
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Includes: Supplementary data
Journal Articles

The importance of inner-shell electronic structure for enhancing the EUV absorption of photoresist materials

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Kristina D. Closser, D. Frank Ogletree, Patrick Naulleau, David Prendergast
Journal: The Journal of Chemical Physics
J. Chem. Phys. 146, 164106 (2017)
https://doi.org/10.1063/1.4981815
Published: April 2017
View articletitled, The importance of inner-shell electronic structure for enhancing the EUV absorption of photoresist materials
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Includes: Supplementary data
Journal Articles

Direct observation of ring-opening dynamics in strong-field ionized selenophene using femtosecond inner-shell absorption spectroscopy

Free
Florian Lackner, Adam S. Chatterley, C. D. Pemmaraju, Kristina D. Closser, David Prendergast, Daniel M. Neumark, Stephen R. Leone, Oliver Gessner
Journal: The Journal of Chemical Physics
J. Chem. Phys. 145, 234313 (2016)
https://doi.org/10.1063/1.4972258
Published: December 2016
View articletitled, Direct observation of ring-opening dynamics in strong-field ionized selenophene using femtosecond inner-shell absorption spectroscopy
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Includes: Supplementary data
Journal Articles

Understanding and control of bipolar self-doping in copper nitride

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Angela N. Fioretti, Craig P. Schwartz, John Vinson, Dennis Nordlund, David Prendergast, Adele C. Tamboli, Christopher M. Caskey, Filip Tuomisto, Florence Linez, Steven T. Christensen, Eric S. Toberer, Stephan Lany, Andriy Zakutayev
Journal: Journal of Applied Physics
J. Appl. Phys. 119, 181508 (2016)
https://doi.org/10.1063/1.4948244
Published: May 2016
View articletitled, Understanding and control of bipolar self-doping in copper nitride
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Includes: Supplementary data
Journal Articles

Synthesis of a mixed-valent tin nitride and considerations of its possible crystal structures

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Christopher M. Caskey, Aaron Holder, Sarah Shulda, Steven T. Christensen, David Diercks, Craig P. Schwartz, David Biagioni, Dennis Nordlund, Alon Kukliansky, Amir Natan, David Prendergast, Bernardo Orvananos, Wenhao Sun, Xiuwen Zhang, Gerbrand Ceder, David S. Ginley, William Tumas, John D. Perkins, Vladan Stevanovic, Svitlana Pylypenko, Stephan Lany, Ryan M. Richards, Andriy Zakutayev
Journal: The Journal of Chemical Physics
J. Chem. Phys. 144, 144201 (2016)
https://doi.org/10.1063/1.4945561
Published: April 2016
View articletitled, Synthesis of a mixed-valent tin nitride and considerations of its possible crystal structures
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Includes: Supplementary data
Journal Articles

Communication: On the difficulty of reproducibly measuring PbCl2 X-ray absorption spectra

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Craig P. Schwartz, David Prendergast
Journal: The Journal of Chemical Physics
J. Chem. Phys. 143, 111102 (2015)
https://doi.org/10.1063/1.4931404
Published: September 2015
View articletitled, Communication: On the difficulty of reproducibly measuring PbCl2 X-ray absorption spectra
Open the PDF for Communication: On the difficulty of reproducibly measuring PbCl2 X-ray absorption spectra in another window
Journal Articles

Properties of aqueous nitrate and nitrite from x-ray absorption spectroscopy

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Jacob W. Smith, Royce K. Lam, Orion Shih, Anthony M. Rizzuto, David Prendergast, Richard J. Saykally
Journal: The Journal of Chemical Physics
J. Chem. Phys. 143, 084503 (2015)
https://doi.org/10.1063/1.4928867
Published: August 2015
View articletitled, Properties of aqueous nitrate and nitrite from x-ray absorption spectroscopy
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