Describing transition metal chemistry with the random phase approximation

被引:0
|
作者
Eshuis, Henk [1 ]
Chedid, Julianna [1 ]
Ferrara, Nashali [1 ]
机构
[1] Montclair State Univ, Chem & Biochem, Little Falls, NJ USA
关键词
D O I
暂无
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
302
引用
收藏
页数:1
相关论文
共 50 条
  • [1] Describing transition metal homogeneous catalysis using the random phase approximation
    Chedid, Julianna
    Ferrara, Nashali M.
    Eshuis, Henk
    THEORETICAL CHEMISTRY ACCOUNTS, 2018, 137 (11)
  • [2] Describing transition metal homogeneous catalysis using the random phase approximation
    Julianna Chedid
    Nashali M. Ferrara
    Henk Eshuis
    Theoretical Chemistry Accounts, 2018, 137
  • [3] Thermochemistry and Geometries for Transition-Metal Chemistry from the Random Phase Approximation
    Waitt, Craig
    Ferrara, Nashali M.
    Eshuis, Henk
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2016, 12 (11) : 5350 - 5360
  • [4] Reference determinant dependence of the random phase approximation in 3d transition metal chemistry
    Bates, Jefferson
    Mezei, Pal
    Csonka, Gabor
    Sun, Jianwei
    Ruzsinszky, Adrienn
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2018, 255
  • [5] Reference Determinant Dependence of the Random Phase Approximation in 3d Transition Metal Chemistry
    Bates, J. E.
    Mezei, P. D.
    Csonka, G. I.
    Sun, J.
    Ruzsinszky, A.
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2017, 13 (01) : 100 - 109
  • [6] FERROMAGNETIC PHASE TRANSITION BEYOND RANDOM PHASE APPROXIMATION
    BHAGAVAN, MR
    JOURNAL OF PHYSICS PART C SOLID STATE PHYSICS, 1971, 4 (15): : 2278 - &
  • [7] Tests of the random phase approximation for transition strengths
    Stetcu, I
    Johnson, CW
    PHYSICAL REVIEW C, 2003, 67 (04):
  • [8] Adsorption energies of benzene on close packed transition metal surfaces using the random phase approximation
    Torres, Jose A. Garrido
    Ramberger, Benjamin
    Fruchtl, Herbert A.
    Schaub, Renald
    Kresse, Georg
    PHYSICAL REVIEW MATERIALS, 2017, 1 (06):
  • [9] RANDOM PHASE APPROXIMATION FOR BOSE SYSTEMS ABOVE THE TEMPERATURE OF PHASE TRANSITION
    Vakarchuk, I. O.
    Pastukhov, V. S.
    JOURNAL OF PHYSICAL STUDIES, 2011, 15 (03):
  • [10] Random Phase Approximation in Surface Chemistry: Water Splitting on Iron
    Karlicky, Frantisek
    Lazar, Petr
    Dubecky, Matus
    Otyepka, Michal
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2013, 9 (08) : 3670 - 3676