Functional properties from molecular dynamics in hybrid perovskite halides

被引:0
|
作者
Mozur, Eve [1 ]
Oswald, Iain [1 ]
Koegel, Alexandra [1 ]
Maughan, Annalise [1 ]
Neilson, James [1 ]
机构
[1] Colorado State Univ, Chem, Ft Collins, CO 80523 USA
来源
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2019年 / 258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
367-INOR
引用
收藏
页数:1
相关论文
共 50 条
  • [41] HYBRID MOLECULAR-DYNAMICS
    HEERMANN, DW
    NIELABA, P
    ROVERE, M
    COMPUTER PHYSICS COMMUNICATIONS, 1990, 60 (03) : 311 - 318
  • [42] Investigation of the optoelectronics properties and stability of Formamidinium lead mixed halides perovskite
    Tour, Abdoulaye
    Bouich, Amal
    Soucasse, Bernabe Mari
    Soro, Donafologo
    OPTICAL MATERIALS, 2023, 135
  • [43] Inferring Functional Properties from Fluid Dynamics Features
    Schillaci, Andrea
    Quadrio, Maurizio
    Pipolo, Carlotta
    Restelli, Marcello
    Boracchi, Giacomo
    2020 25TH INTERNATIONAL CONFERENCE ON PATTERN RECOGNITION (ICPR), 2021, : 4091 - 4098
  • [44] Structural evolution and photoluminescence properties of hybrid antimony halides
    Ma, Yue-Yu
    Pan, Hong-Mei
    Li, Dong-Yang
    Liu, Yu-Hang
    Lu, Tian
    Lei, Xiao-Wu
    Jing, Zhihong
    Journal of Solid State Chemistry, 2022, 314
  • [45] Structural evolution and photoluminescence properties of hybrid antimony halides
    Ma, Yue-Yu
    Pan, Hong-Mei
    Li, Dong-Yang
    Liu, Yu-Hang
    Lu, Tian
    Lei, Xiao-Wu
    Jing, Zhihong
    JOURNAL OF SOLID STATE CHEMISTRY, 2022, 314
  • [46] The nuclear pore complex: from molecular architecture to functional dynamics
    Stoffler, D
    Fahrenkrog, B
    Aebi, U
    CURRENT OPINION IN CELL BIOLOGY, 1999, 11 (03) : 391 - 401
  • [47] A hybrid density functional classical molecular dynamics simulation of a water molecule in liquid water
    Tunon, I
    MartinsCosta, MTC
    Millot, C
    RuizLopez, MF
    JOURNAL OF MOLECULAR MODELING, 1995, 1 (04): : 196 - 201
  • [48] Enhancing the phosphorescence of hybrid metal halides through molecular sensitization
    Gong, Liao-Kuo
    Li, Jian-Rong
    Wu, Zhao-Feng
    Hu, Bing
    Wang, Ze-Ping
    Shen, Nan-Nan
    Hu, Qian-Qian
    Deng, Zhong-Hua
    Zhang, Zhi-Zhuan
    Fu, Jing-Jing
    Du, Ke-Zhao
    Huang, Xiao-Ying
    JOURNAL OF MATERIALS CHEMISTRY C, 2019, 7 (32) : 9803 - 9807
  • [49] Band gaps and structural properties of graphene halides and their derivates: A hybrid functional study with localized orbital basis sets
    Karlicky, Frantisek
    Zboril, Radek
    Otyepka, Michal
    JOURNAL OF CHEMICAL PHYSICS, 2012, 137 (03):
  • [50] Extracting ammonium halides by solvent from the hybrid perovskites with various dimensions to promote the crystallization of CsPbI3 perovskite
    Wang, Hailiang
    Liu, Huicong
    Dong, Zijing
    Wei, Xueyuan
    Song, Yongfa
    Li, Weiping
    Zhu, Liqun
    Bai, Yang
    Chen, Haining
    NANO ENERGY, 2022, 94