Molecular dynamics simulations of uranyl-peroxide nanocapsules in aqueous solution

被引：0
|
作者：
Vlaisavljevich, Bess [1 ,2 ]
Miro, Pere [1 ,2 ]
Hu, Shuxian [1 ,2 ]
Dzubak, Allison [1 ,2 ]
Spezia, Riccardo [3 ]
Cramer, Christopher J. [1 ,2 ]
Gagliardi, Laura [1 ,2 ]
机构：
[1] Chem Theory Ctr, Dept Chem, Minneapolis, MN 55455 USA
[2] Univ Minnesota, Inst Supercomp, Minneapolis, MN 55455 USA
[3] Univ Evry Val dEssonne, CNRS, Lab Anal & Modelisat Biol & Environm, F-91025 Evry, France
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2013年 / 245卷
关键词：
D O I：
暂无
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
71-COMP
引用
收藏
页数：1
相关论文
共 50 条
  • [1] Molecular dynamics simulations of uranyl-peroxide nanocapsules in aqueous solution
    Vlaisavljevich, Bess
    Miro, Pere
    Hu, Shuxian
    Dzubak, Allison
    Spezia, Riccardo
    Cramer, Christopher J.
    Gagliardi, Laura
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2013, 245
  • [2] Uranyl-Peroxide Nanocapsules in Aqueous Solution: Force Field Development and First Applications
    Miro, Pere
    Vlaisavljevich, Bess
    Dzubak, Allison L.
    Hu, Shuxian
    Burns, Peter C.
    Cramer, Christopher J.
    Spezia, Riccardo
    Gagliardi, Laura
    JOURNAL OF PHYSICAL CHEMISTRY C, 2014, 118 (42): : 24730 - 24740
  • [3] Speciation of uranyl-peroxide species: from molecules to nanocapsules
    Miro, Pere
    Rabbani, S. M. Gulam
    Hare, Ethan
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2019, 257
  • [4] What do uranyl-peroxide nanocapsules have in their pockets?
    Ramirez, Pere Miro
    Vlaisavjevich, Bess
    Gil, Adria
    Burns, Peter C.
    Nyman, May
    Bo, Carles
    Cramer, Christopher J.
    Gagliardi, Laura
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2014, 247
  • [5] Uranyl-Peroxide Nanocapsules in Aqueous Solution: Force Field Development and First Applications (vol 118, pg 24730, 2014)
    Miro, Pere
    Vlaisavljevich, Bess
    Dzubak, Allison L.
    Hu, Shuxian
    Burns, Peter C.
    Cramer, Christopher J.
    Spezia, Riccardo
    Gagliardi, Laura
    JOURNAL OF PHYSICAL CHEMISTRY C, 2015, 119 (27): : 15778 - 15778
  • [6] Uranyl-peroxide nanocapsules: From self-assembly to isomerism
    Miro, Pere
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 253
  • [7] Dynamics of uranyl peroxide nanocapsules
    Nyman, M. (may.nyman@oregonstate.edu), 1600, American Chemical Society (134):
  • [8] Dynamics of Uranyl Peroxide Nanocapsules
    Nyman, May
    Alam, Todd M.
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2012, 134 (49) : 20131 - 20138
  • [9] Self-Assembly of Uranyl-Peroxide Nanocapsules in Basic Peroxidic Environments
    Miro, Pere
    Vlaisavljevich, Bess
    Gil, Adria
    Burns, Peter C.
    Nyman, May
    Bo, Carles
    CHEMISTRY-A EUROPEAN JOURNAL, 2016, 22 (25) : 8571 - 8578
  • [10] On the origin of the cation templated self-assembly of uranyl-peroxide nanocapsules
    Miro, Pere
    Pierrefixe, Simon
    Gicquel, Mickael
    Gil, Adria
    Bo, Carles
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2012, 243
12345