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Journal Articles
Bayesian-recovered ultrafast dynamics in solids across four decades of time and energy
Available to Purchase
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 163, 024202 (2025)
Published: July 2025
Journal Articles
Tunable layer-specific polarizability in twisted multilayer graphene flakes capped with hexagonal boron nitride
Available to Purchase
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 234706 (2025)
Published: June 2025
Journal Articles
Simulating iron in oxygen-containing environments: An improved Fe–O interaction for density-functional tight-binding
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 224107 (2025)
Published: June 2025
Journal Articles
Flexible graphene/PAM/PVA hydrogel composites with highly dispersed cobalt nanoparticles for enhanced microwave absorption
Available to PurchaseYujie Gui, Xiaolin Fu, Yafei Liu, Xu Zhang, Hai Xie, Pengjun Ma, Bingjun Yang, Huixia Feng, Juan Yang
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 164704 (2025)
Published: April 2025
Journal Articles
Journal Articles
Ehrenfest dynamics with localized atomic-orbital basis sets within the projector augmented-wave method
Open Access
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 124117 (2025)
Published: March 2025
Journal Articles
Journal Articles
Influence of surface chemistry on Li nucleation energetics on graphene-based surfaces
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 054703 (2025)
Published: February 2025
Journal Articles
Characterization of interactions in battery slurry via MD simulation: Influence on miscibility, morphology, and dispersion with varying ACN content in HNBR
Available to PurchaseAnseong Park, Seungtae Kim, Je-Yeon Jung, WooJin Kim, Min Young Seo, Sangdeok Kim, Chongyong Nam, Won Bo Lee, YongJoo Kim
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 234905 (2024)
Published: December 2024
Journal Articles
Vibrational strong coupling of organic molecules embedded within graphene plasmon nanocavities facilitated by perfect absorbers
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 234703 (2024)
Published: December 2024
Journal Articles
Journal Articles
Two-dimensional optical binding based on graphene surface plasmon excitation
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 214101 (2024)
Published: December 2024
Journal Articles
Surface plasmons on silver gratings transform pyrolytic carbon into luminescent graphitized carbon dots
Available to PurchaseJaspreet Walia, Sabaa Rashid, Maryam Sadat Amiri Naeini, Graham Killaire, Fabio Variola, Arnaud Weck, Pierre Berini
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 144702 (2024)
Published: October 2024
Journal Articles
The influence of the bounding surface on the structural ordering of short chains of oligoetherimides
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 114901 (2024)
Published: September 2024
Journal Articles
Imaging nanoscale molecular binding in functionalized graphene via tip-enhanced Raman spectroscopy
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 094204 (2024)
Published: September 2024
Journal Articles
Electrostatic energy-driven contact electrification mechanism from the ReaxFF molecular dynamics perspective
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 094702 (2024)
Published: September 2024
Journal Articles
MXene enhanced reduced graphene oxide aerogel for high-performance supercapacitors
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 074704 (2024)
Published: August 2024
Journal Articles
PVP-assisted synthesis of NiSnO3 firmly anchored on graphene as a high-performance lithium battery: A combination of theoretical and experimental study
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 074201 (2024)
Published: August 2024
Includes: Supplementary data
Journal Articles
Journal Articles
Raman spectroscopy and photoluminescence study of PN junction p-graphene/n-GaAs
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 044701 (2024)
Published: July 2024
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