Electronic structure calculations on a real-space mesh with multigrid acceleration

被引:0
|
作者
Sullivan, DJ [1 ]
Briggs, EL [1 ]
Brabec, CJ [1 ]
Bernholc, J [1 ]
机构
[1] N CAROLINA STATE UNIV,DEPT PHYS,RALEIGH,NC 27695
来源
MATERIALS THEORY, SIMULATIONS, AND PARALLEL ALGORITHMS | 1996年 / 408卷
关键词
D O I
暂无
中图分类号
TP301 [理论、方法];
学科分类号
081202 ;
摘要
引用
收藏
页码:145 / 156
页数:12
相关论文
共 50 条
  • [31] ARES: An efficient real-space electronic structure calculation package
    Xu, Qiang
    Wang, Sheng
    Shao, Xuecheng
    Wang, Yanchao
    Ma, Yanming
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2019, 257
  • [32] Real-space multigrid method for linear-response quantum transport in molecular electronic devices
    Feng, Guogang
    Wijesekera, Nimal
    Beck, Thomas L.
    IEEE TRANSACTIONS ON NANOTECHNOLOGY, 2007, 6 (02) : 238 - 244
  • [33] Multigrid method for electronic structure calculations
    Heiskanen, M
    Torsti, T
    Puska, MJ
    Nieminen, RM
    PHYSICAL REVIEW B, 2001, 63 (24)
  • [34] ACRES: Adaptive coordinate real-space electronic structure.
    Modine, NA
    Zumbach, G
    Waghmare, UV
    Smith, GS
    Kaxiras, E
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1998, 215 : U223 - U223
  • [35] GaAs and InAs(001) surface structures from large-scale real-space multigrid calculations
    Schmidt, WG
    Hahn, PH
    Bechstedt, F
    HIGH PERFORMANCE COMPUTING IN SCIENCE AND ENGINEERING 01, 2002, : 178 - 188
  • [36] Electronic calculations on the MgTiOBO3 warwickite: A real-space renormalization approach
    Marcucci, D. C.
    Latge, A.
    Anda, E. V.
    Matos, M.
    Physical Review B: Condensed Matter, 56 (07):
  • [37] Electronic calculations on the MgTiOBO3 warwickite: A real-space renormalization approach
    Marcucci, DC
    Latge, A
    Anda, EV
    Matos, M
    Fernandes, JC
    PHYSICAL REVIEW B, 1997, 56 (07): : 3672 - 3677
  • [38] REAL-SPACE RENORMALIZATION-GROUP APPROACH TO THE MULTIGRID METHOD
    VYAS, V
    PHYSICAL REVIEW D, 1991, 43 (10): : 3465 - 3474
  • [39] Real-space mapping of electronic orbitals
    Loeffler, Stefan
    Bugnet, Matthieu
    Gauquelin, Nicolas
    Lazar, Sorin
    Assmann, Elias
    Held, Karsten
    Botton, Gianluigi A.
    Schattschneider, Peter
    ULTRAMICROSCOPY, 2017, 177 : 26 - 29
  • [40] A REAL-SPACE APPROACH TO ELECTRONIC TRANSPORT
    MAYOU, D
    KHANNA, SN
    JOURNAL DE PHYSIQUE I, 1995, 5 (09): : 1199 - 1211