E-LIB Suche - Ergebnisse für: Errington, Jeffrey R.

1

Efficiency Comparison of Single- and Multiple-Macrostate Gr..:

Hatch, Harold W. ; Siderius, Daniel W. ; Errington, Jeffrey R..
The Journal of Physical Chemistry B. 127 (2023) 13 - p. 3041-3051 , 2023

Link: https://doi.org/10.1021/..

2

Comments on "Monte Carlo simulations for water adsorption i..:

Siderius, Daniel W. ; Hatch, Harold W. ; Errington, Jeffrey R..
AIChE Journal. 68 (2022) 8 - p. , 2022

Link: https://doi.org/10.1002/..

3

Coupled Monte Carlo and Molecular Dynamics Simulations on I..:

Chen, Yiqi ; Schultz, Andrew J. ; Errington, Jeffrey R.
The Journal of Physical Chemistry B. 125 (2021) 29 - p. 8193-8204 , 2021

Link: https://doi.org/10.1021/..

4

Flat-histogram extrapolation as a useful tool in the age of..:

Mahynski, Nathan A. ; Hatch, Harold W. ; Witman, Matthew...
Molecular Simulation. 47 (2020) 5 - p. 395-407 , 2020

Link: https://doi.org/10.1080/..

5

Using isothermal-isobaric Monte Carlo simulation to study t..:

Jain, Karnesh ; Rane, Kaustubh S. ; Errington, Jeffrey R.
The Journal of Chemical Physics. 150 (2019) 8 - p. , 2019

Link: https://doi.org/10.1063/..

6

Improving the efficiency of Monte Carlo simulations of ions..:

Hatch, Harold W. ; Hall, Steven W. ; Errington, Jeffrey R..
The Journal of Chemical Physics. 151 (2019) 14 - p. , 2019

Link: https://doi.org/10.1063/..

7

Effect of Carboxylic Acid on the Wetting Properties of a Mo..:

Guo, Wenjing ; Errington, Jeffrey R.
Langmuir. 35 (2019) 20 - p. 6540-6549 , 2019

Link: https://doi.org/10.1021/..

8

Construction of the interface potential from a series of ca..:

Jain, Karnesh ; Schultz, Andrew J. ; Errington, Jeffrey R.
The Journal of Chemical Physics. 151 (2019) 4 - p. , 2019

Link: https://doi.org/10.1063/..

9

Effect of Surface Hydrophilicity on the Interfacial Propert..:

Guo, Wenjing ; Errington, Jeffrey R.
The Journal of Physical Chemistry C. 123 (2019) 32 - p. 19649-19658 , 2019

Link: https://doi.org/10.1021/..

10

Application of the interface potential approach for studyin..:

Jain, Karnesh ; Schultz, Andrew J. ; Errington, Jeffrey R.
The Journal of Chemical Physics. 150 (2019) 20 - p. , 2019

Link: https://doi.org/10.1063/..

11

Free energy and concentration of crystalline vacancies by m..:

Purohit, Apoorva ; Schultz, Andrew J. ; Moustafa, Sabry G...
Molecular Physics. 116 (2018) 21-22 - p. 3027-3041 , 2018

Link: https://doi.org/10.1080/..

12

Monte Carlo Simulation Strategies to Compute the Interfacia..:

Guo, Wenjing ; Errington, Jeffrey R.
The Journal of Physical Chemistry C. 122 (2018) 30 - p. 17309-17318 , 2018

Link: https://doi.org/10.1021/..

13

Calculation of the Saturation Properties of a Model Octane–..:

Guo, Wenjing ; Bali, Prannay ; Errington, Jeffrey R.
The Journal of Physical Chemistry B. 122 (2018) 23 - p. 6260-6271 , 2018

Link: https://doi.org/10.1021/..

14

Position-Dependent Dynamics Explain Pore-Averaged Diffusion..:

Krekelberg, William P. ; Siderius, Daniel W. ; Shen, Vincent K...
Langmuir. 33 (2017) 49 - p. 13955-13963 , 2017

Link: https://doi.org/10.1021/..

15

Multivariable extrapolation of grand canonical free energy ..:

Mahynski, Nathan A. ; Errington, Jeffrey R. ; Shen, Vincent K.
The Journal of Chemical Physics. 147 (2017) 23 - p. , 2017

Link: https://doi.org/10.1063/..