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Journal Articles

Driven transport of active particles through arrays of symmetric obstacles

Shubhadip Nayak, Sohom Das, Poulami Bag, Tanwi Debnath, Pulak K. Ghosh

J. Chem. Phys. 159, 164109 (2023)

https://doi.org/10.1063/5.0176523

Published: October 2023

View article titled, Driven transport of active particles through arrays of symmetric obstacles

Journal Articles

Understanding dynamics in coarse-grained models. III. Roles of rotational motion and translation-rotation coupling in coarse-grained dynamics

Jaehyeok Jin, Eok Kyun Lee, Gregory A. Voth

J. Chem. Phys. 159, 164102 (2023)

https://doi.org/10.1063/5.0167158

Published: October 2023

View article titled, Understanding dynamics in coarse-grained models. III. Roles of rotational motion and translation-rotation coupling in coarse-grained dynamics

Journal Articles

The Debye’s model for the dielectric relaxation of liquid water and the role of cross-dipolar correlations. A MD-simulations study

Fernando Alvarez, Arantxa Arbe, Juan Colmenero

J. Chem. Phys. 159, 134505 (2023)

https://doi.org/10.1063/5.0168588

Published: October 2023

View article titled, The Debye’s model for the dielectric relaxation of liquid water and the role of cross-dipolar correlations. A MD-simulations study

Journal Articles

Dynamics of wire frame glasses in two dimensions

David A. King

J. Chem. Phys. 159, 094903 (2023)

https://doi.org/10.1063/5.0164438

Published: September 2023

View article titled, Dynamics of wire frame glasses in two dimensions

Journal Articles

Diffusion coefficients of linear trimer particles

Anton Lüders, Bastian Heß, Peter Nielaba

J. Chem. Phys. 159, 054901 (2023)

https://doi.org/10.1063/5.0158286

Published: August 2023

View article titled, Diffusion coefficients of linear trimer particles

Includes: Supplementary data

Journal Articles

Mode-coupling theory for mixtures of athermal self-propelled particles

Vincent E. Debets, Liesbeth M. C. Janssen

J. Chem. Phys. 159, 014502 (2023)

https://doi.org/10.1063/5.0155142

Published: July 2023

View article titled, Mode-coupling theory for mixtures of athermal self-propelled particles

Journal Articles

Computational modeling of passive transport of functionalized nanoparticles

Daniela Moreno-Chaparro, Nicolas Moreno, Florencio Balboa Usabiaga, Marco Ellero

J. Chem. Phys. 158, 104108 (2023)

https://doi.org/10.1063/5.0136833

Published: March 2023

View article titled, Computational modeling of passive transport of functionalized nanoparticles

Journal Articles

Relaxation dynamics measure the aggregation propensity of amyloid-β and its mutants

Priya Dey, Parbati Biswas

J. Chem. Phys. 158, 105101 (2023)

https://doi.org/10.1063/5.0138189

Published: March 2023

View article titled, Relaxation dynamics measure the aggregation propensity of amyloid-<em>β</em> and its mutants

Includes: Supplementary data

Journal Articles

Boundary homogenization for patchy surfaces trapping patchy particles

Claire E. Plunkett, Sean D. Lawley

J. Chem. Phys. 158, 094104 (2023)

https://doi.org/10.1063/5.0135048

Published: March 2023

View article titled, Boundary homogenization for patchy surfaces trapping patchy particles

Journal Articles

Effects of flexibility in coarse-grained models for bovine serum albumin and immunoglobulin G

Frank Hirschmann, Hender Lopez, Felix Roosen-Runge, Tilo Seydel, Frank Schreiber, Martin Oettel

J. Chem. Phys. 158, 084112 (2023)

https://doi.org/10.1063/5.0132493

Published: February 2023

View article titled, Effects of flexibility in coarse-grained models for bovine serum albumin and immunoglobulin G

Includes: Supplementary data

Journal Articles

Simulations of electric field gradient fluctuations and dynamics around sodium ions in ionic liquids

Yann Gimbal-Zofka, Beatrice Karg, Katarzyna Dziubinska-Kühn, Magdalena Kowalska, Tomasz A. Wesolowski, Christopher A. Rumble

J. Chem. Phys. 157, 244502 (2022)

https://doi.org/10.1063/5.0126693

Published: December 2022

View article titled, Simulations of electric field gradient fluctuations and dynamics around sodium ions in ionic liquids

Includes: Supplementary data

Journal Articles

Active glassy dynamics is unaffected by the microscopic details of self-propulsion

Vincent E. Debets, Liesbeth M. C. Janssen

J. Chem. Phys. 157, 224902 (2022)

https://doi.org/10.1063/5.0127569

Published: December 2022

View article titled, Active glassy dynamics is unaffected by the microscopic details of self-propulsion

Journal Articles

Oriented attachment kinetics for rod-like particles at a flat surface: Buffon’s needle at the nanoscale

Kartik Kamat, Pavithra M. Naullage, Valeria Molinero, Baron Peters

J. Chem. Phys. 157, 214113 (2022)

https://doi.org/10.1063/5.0124531

Published: December 2022

View article titled, Oriented attachment kinetics for rod-like particles at a flat surface: Buffon’s needle at the nanoscale

Includes: Supplementary data

Journal Articles

Rotational dynamics of water associated with interfacial dielectric oscillation and its role in crystal growth of ice

Chenchen Guo, Hairong Qin, Yong Zhu, Min Chen, Yongjun Lü

J. Chem. Phys. 157, 214703 (2022)

https://doi.org/10.1063/5.0107777

Published: December 2022

View article titled, Rotational dynamics of water associated with interfacial dielectric oscillation and its role in crystal growth of ice

Includes: Supplementary data

Journal Articles

Persistence of an active asymmetric rigid Brownian particle in two dimensions

Anirban Ghosh, Sudipta Mandal, Dipanjan Chakraborty

J. Chem. Phys. 157, 194905 (2022)

https://doi.org/10.1063/5.0119081

Published: November 2022

View article titled, Persistence of an active asymmetric rigid Brownian particle in two dimensions

Journal Articles

Detailed dynamics of discrete Gaussian semiflexible chains with arbitrary stiffness along the contour

Andrés R. Tejedor, Jaime R. Tejedor, Jorge Ramírez

J. Chem. Phys. 157, 164904 (2022)

https://doi.org/10.1063/5.0112951

Published: October 2022

View article titled, Detailed dynamics of discrete Gaussian semiflexible chains with arbitrary stiffness along the contour

Includes: Supplementary data

Journal Articles

The effects of polarization on the rotational diffusion of ions in organic ionic plastic crystals

Seowoo Park, Hyungshick Park, Chung Bin Park, Bong June Sung

J. Chem. Phys. 157, 144501 (2022)

https://doi.org/10.1063/5.0102937

Published: October 2022

View article titled, The effects of polarization on the rotational diffusion of ions in organic ionic plastic crystals

Journal Articles

Active chiral molecules in activity gradients

Pietro Luigi Muzzeddu, Hidde Derk Vuijk, Hartmut Löwen, Jens-Uwe Sommer, Abhinav Sharma

J. Chem. Phys. 157, 134902 (2022)

https://doi.org/10.1063/5.0109817

Published: October 2022

View article titled, Active chiral molecules in activity gradients

Includes: Supplementary data

Journal Articles

Publisher’s Note: “War and peace between electrostatic and van der Waals forces regulate translational and rotational diffusion” [J. Chem. Phys. 157, 080901 (2022)]

Dmitry V. Matyushov

J. Chem. Phys. 157, 139902 (2022)

https://doi.org/10.1063/5.0124698

Published: October 2022

View article titled, Publisher’s Note: “War and peace between electrostatic and van der Waals forces regulate translational and rotational diffusion” [J. Chem. Phys. 157, 080901 (2022)]

Journal Articles

Cross-correlation effects in the solution NMR spectra of near-equivalent spin-1/2 pairs

James W. Whipham, Gamal A. I. Moustafa, Mohamed Sabba, Weidong Gong, Christian Bengs, Malcolm H. Levitt

J. Chem. Phys. 157, 104112 (2022)

https://doi.org/10.1063/5.0107221

Published: September 2022

View article titled, Cross-correlation effects in the solution NMR spectra of near-equivalent spin-1/2 pairs

Includes: Supplementary data

NARROW

Topics

Driven transport of active particles through arrays of symmetric obstacles

Understanding dynamics in coarse-grained models. III. Roles of rotational motion and translation-rotation coupling in coarse-grained dynamics

The Debye’s model for the dielectric relaxation of liquid water and the role of cross-dipolar correlations. A MD-simulations study

Dynamics of wire frame glasses in two dimensions

Diffusion coefficients of linear trimer particles

Mode-coupling theory for mixtures of athermal self-propelled particles

Computational modeling of passive transport of functionalized nanoparticles

Relaxation dynamics measure the aggregation propensity of amyloid-β and its mutants

Boundary homogenization for patchy surfaces trapping patchy particles

Effects of flexibility in coarse-grained models for bovine serum albumin and immunoglobulin G

Simulations of electric field gradient fluctuations and dynamics around sodium ions in ionic liquids

Active glassy dynamics is unaffected by the microscopic details of self-propulsion

Oriented attachment kinetics for rod-like particles at a flat surface: Buffon’s needle at the nanoscale

Rotational dynamics of water associated with interfacial dielectric oscillation and its role in crystal growth of ice

Persistence of an active asymmetric rigid Brownian particle in two dimensions

Detailed dynamics of discrete Gaussian semiflexible chains with arbitrary stiffness along the contour

The effects of polarization on the rotational diffusion of ions in organic ionic plastic crystals

Active chiral molecules in activity gradients

Publisher’s Note: “War and peace between electrostatic and van der Waals forces regulate translational and rotational diffusion” [J. Chem. Phys. 157, 080901 (2022)]

Cross-correlation effects in the solution NMR spectra of near-equivalent spin-1/2 pairs

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