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Maginn, Edward J.
276
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Online (276)
Mediatypes
E-Books (1)
Articles (Online) (231)
OpenAccess-fulltext (43)
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1
Interaction Between Endocrine Disruptors and Polyethylene N..:
Oliveira, Yamara Matos
;
Vernin, Nathalia Salles
;
Zhang, Yong
..
The Journal of Physical Chemistry B. 128 (2024) 8 - p. 2045-2052 , 2024
Link:
https://doi.org/10.1021/..
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2
Stochastic machine learning via sigma profiles to build a d..:
Abranches, Dinis O.
;
Maginn, Edward J.
;
Colón, Yamil J.
Proceedings of the National Academy of Sciences. 121 (2024) 31 - p. , 2024
Link:
https://doi.org/10.1073/..
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3
Impact of fluorination on Li+ solvation and dynamics in ion..:
Penley, Drace
;
Gerber, Hazel
;
Garaga, Mounesha N.
...
Journal of Power Sources. 593 (2024) - p. 233984 , 2024
Link:
https://doi.org/10.1016/..
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4
Chain length and OH-spacing effects on diol-based deep eute..:
Pandian, Rathiesh
;
Kim, Daniel
;
Zhang, Yong
...
Journal of Molecular Liquids. 393 (2024) - p. 123534 , 2024
Link:
https://doi.org/10.1016/..
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5
Symmetry versus asymmetry game in vaporization enthalpies o..:
Verevkin, Sergey P.
;
Zaitsau, Dzmitry H.
;
Nagrimanov, Ruslan N.
...
Journal of Molecular Liquids. 395 (2024) - p. 123850 , 2024
Link:
https://doi.org/10.1016/..
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6
GAFF-Based Polarizable Force Field Development and Validati..:
Wang, Ning
;
Maginn, Edward J.
The Journal of Physical Chemistry B. 128 (2024) 3 - p. 871-881 , 2024
Link:
https://doi.org/10.1021/..
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7
Consistent and reproducible computation of the glass transi..:
Carmona Esteva, Fernando J.
;
Zhang, Yong
;
Maginn, Edward J.
.
The Journal of Chemical Physics. 161 (2024) 1 - p. , 2024
Link:
https://doi.org/10.1063/..
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8
Ionic Liquids for the Separation of Fluorocarbon Refrigeran..:
Baca, Kalin R.
;
Al-Barghouti, Karim
;
Wang, Ning
...
Chemical Reviews. 124 (2024) 9 - p. 5167-5226 , 2024
Link:
https://doi.org/10.1021/..
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9
GAFF-Based Polarizable Force Field Development and Validati..:
Ning Wang
;
Edward J. Maginn
doi:10.1021/acs.jpcb.3c07238.s001. , 2024
Link:
https://doi.org/10.1021/..
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10
GAFF-Based Polarizable Force Field Development and Validati..:
Ning Wang
;
Edward J. Maginn
doi:10.1021/acs.jpcb.3c07238.s001. , 2024
Link:
https://doi.org/10.1021/..
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11
Molecular Dynamics Simulation of the Influence of External ..:
Carmona Esteva, Fernando J.
;
Zhang, Yong
;
Colón, Yamil J.
.
The Journal of Physical Chemistry B. 127 (2023) 20 - p. 4623-4632 , 2023
Link:
https://doi.org/10.1021/..
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12
Tribute to Doros N. Theodorou:
Maginn, Edward J.
;
Economou, Ioannis G.
;
Snurr, Randall Q.
.
The Journal of Physical Chemistry B. 127 (2023) 12 - p. 2639-2642 , 2023
Link:
https://doi.org/10.1021/..
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13
Revisiting the pseudo-supercritical path method: An improve..:
Correa, Gabriela B.
;
Zhang, Yong
;
Abreu, Charlles R. A.
..
The Journal of Chemical Physics. 159 (2023) 10 - p. , 2023
Link:
https://doi.org/10.1063/..
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14
Rapid screening of gas solubility in ionic liquids using bi..:
Smith, Ryan W.
;
Maginn, Edward J.
Molecular Simulation. 50 (2023) 1 - p. 26-42 , 2023
Link:
https://doi.org/10.1080/..
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15
Effect of Antisolvent Additives in Aqueous Zinc Sulfate Ele..:
Ilic, Stefan
;
Counihan, Michael J.
;
Lavan, Sydney N.
...
ACS Energy Letters. 9 (2023) 1 - p. 201-208 , 2023
Link:
https://doi.org/10.1021/..
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