First principles modeling of complex perovskites for energy applications

被引：0
|
作者：
Kukla, Maija [1 ]
Kotomin, Eugene A. [2 ]
Fuks, David [4 ]
Mastrikov, Yu A. [3 ]
Sharia, Onise [1 ]
Merkle, Rotraut [2 ]
Maier, Joachim [2 ]
机构：
[1] Univ Maryland, Mat Sci & Engn Dept, College Pk, MD 20742 USA
[2] Max Planck Inst Solid State Res, Stuttgart, Germany
[3] Latvian State Univ, Inst Solid State Phys, LV-1063 Riga, Latvia
[4] Ben Gurion Univ Negev, Dept Mat Engn, IL-84105 Beer Sheva, Israel
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2013年 / 246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：
419-COLL
引用
收藏
页数：1
相关论文
共 50 条
  • [41] Modeling of Integrated Energy Supply Systems: Main Principles, Model, and Applications
    Voropai, Nikolai
    Stennikov, Valery
    Senderov, Sergey
    Barakhtenko, Evgeny
    Voitov, Oleg
    Ustinov, Alexander
    JOURNAL OF ENERGY ENGINEERING, 2017, 143 (05)
  • [42] Modeling of Lead Halide Perovskites for Photovoltaic Applications
    Jishi, Radi A.
    Ta, Oliver B.
    Sharif, Adel A.
    JOURNAL OF PHYSICAL CHEMISTRY C, 2014, 118 (49): : 28344 - 28349
  • [43] Modeling of complex oxide materials from the first principles: systematic applications to vanadates RVO3 with distorted perovskite structure
    Igor Solovyev
    Journal of Computational Electronics, 2011, 10 : 21 - 34
  • [44] Modeling of complex oxide materials from the first principles: systematic applications to vanadates RVO3 with distorted perovskite structure
    Solovyev, Igor
    JOURNAL OF COMPUTATIONAL ELECTRONICS, 2011, 10 (1-2) : 21 - 34
  • [45] First-principles based multiscale multiparadigm methods with applications to complex material
    Goddard, William
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 253
  • [46] Applications of ultrafast spectroscopy to sunscreen development, from first principles to complex mixtures
    Holt, Emily L.
    Stavros, Vasilios G.
    INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY, 2019, 38 (02) : 243 - 285
  • [47] First principles modeling of nanostructures
    Öǧüt, Serdar
    Turkish Journal of Physics, 2003, 27 (05): : 443 - 458
  • [48] First Principles Investigation of Fluorine Based Strontium Series of Perovskites
    Nazia Erum
    Muhammad Azhar Iqbal
    CommunicationsinTheoreticalPhysics, 2016, 66 (11) : 571 - 578
  • [49] Identification of lead-free double halide perovskites for promising photovoltaic applications: first-principles calculations
    Gourav, K.
    Ramachndran, K.
    EUROPEAN PHYSICAL JOURNAL PLUS, 2023, 138 (02):
  • [50] First-principles property assessment of hybrid formate perovskites
    Popoola, Abduljelili
    Ghosh, P. S.
    Kingsland, Maggie
    Kashikar, Ravi
    DeTellem, D.
    Xu, Yixuan
    Ma, S.
    Witanachchi, S.
    Lisenkov, S.
    Ponomareva, I.
    JOURNAL OF CHEMICAL PHYSICS, 2023, 159 (07):
12345