Stochastic evaluation of second-order many-body perturbation corrections to energies and Dyson self-energies

被引:0
作者
Willow, Soohaeng Y. [1 ,2 ]
Kim, Kwang S. [2 ]
Hirata, So [1 ]
机构
[1] Univ Illinois, Dept Chem, Urbana, IL 61801 USA
[2] Pohang Univ Sci & Technol, Dept Chem, Pohang, South Korea
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
77-PHYS
引用
收藏
页数:1
相关论文
共 50 条
[41]   O(N) Stochastic Evaluation of Many-Body van der Waals Energies in Large Complex Systems [J].
Poier, Pier Paolo ;
Lagardere, Louis ;
Piquemal, Jean-Philip .
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2022, 18 (03) :1633-1645
[42]   ON CHOICE OF VIRTUAL ORBITALS IN A MANY-BODY PERTURBATION CALCULATION OF PAIR-CORRELATION ENERGIES [J].
MUKHERJEE, D ;
MOITRA, RK ;
MUKHOPADHYAY, A .
INDIAN JOURNAL OF PHYSICS, 1974, 48 (05) :474-476
[43]   Excitation energies and oscillator strengths of CaI using multireference many-body perturbation theory [J].
Majumder, S ;
Das, BP ;
Chaudhuri, RK .
PHYSICAL REVIEW A, 1999, 59 (05) :3432-3439
[44]   PAIR-CORRELATION ENERGIES IN SODIUM HYDRIDE WITH MANY-BODY PERTURBATION-THEORY [J].
BARTLETT, RJ ;
SILVER, DM .
PHYSICAL REVIEW A, 1974, 10 (06) :1927-1931
[45]   Second-order many-body perturbation and coupled-cluster singles and doubles study of ice VIII [J].
Gilliard, Kandis ;
Sode, Olaseni ;
Hirata, So .
JOURNAL OF CHEMICAL PHYSICS, 2014, 140 (17)
[46]   Second-order many-body perturbation theory with non-canonical and non-orthogonal orbitals [J].
Finley, JP ;
Hirao, K .
CHEMICAL PHYSICS LETTERS, 2000, 328 (1-2) :51-59
[47]   DIAGRAMMATIC MANY-BODY PERTURBATION EXPANSION FOR ATOMS AND MOLECULES .3. 3RD-ORDER RING ENERGIES [J].
WILSON, S .
COMPUTER PHYSICS COMMUNICATIONS, 1978, 14 (1-2) :91-98
[48]   Convergence Acceleration of Parallel Monte Carlo Second-Order Many-Body Perturbation Calculations Using Redundant Walkers [J].
Willow, Soohaeng Yoo ;
Hermes, Matthew R. ;
Kim, Kwang S. ;
Hirata, So .
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2013, 9 (10) :4396-4402
[49]   Connections between second-order Gorling-Levy and many-body perturbation approaches in density functional theory [J].
Ivanov, S ;
Hirata, S ;
Grabowski, I ;
Bartlett, RJ .
JOURNAL OF CHEMICAL PHYSICS, 2003, 118 (02) :461-470
[50]   Efficient Structure Optimization with Second-Order Many-Body Perturbation Theory: The RIJCOSX-MP2 Method [J].
Kossmann, Simone ;
Neese, Frank .
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2010, 6 (08) :2325-2338