Performance of heterogeneous computing with graphics processing unit and many integrated core for hartree potential calculations on a numerical grid-Reference-Cited by-同舟云学术

登录注册会员服务联系我们

Performance of heterogeneous computing with graphics processing unit and many integrated core for hartree potential calculations on a numerical grid

Published:2016-07-19 Issue:24 Volume:37 Page:2193-2201
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Choi Sunghwan¹²,Kwon Oh-Kyoung²³,Kim Jaewook¹,Kim Woo Youn¹

Affiliation:

1. Department of Chemistry; KAIST, 291 Daehak-Ro; Yuseong-Gu Daejeon 34141 Republic of Korea

2. Supercomputing Service Center, Korea Institute of Science and Technology Information; 245 Daehak-Ro Yuseong-Gu Daejeon 34141 Republic of Korea

3. School of Computing; KAIST, 291 Daehak-Ro; Yuseong-Gu Daejeon 34141 Republic of Korea

Funder

National Research Foundation of Korea

NRF (EDISON Program)

EWon associate professorship

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/jcc.24443/fullpdf

Reference64 articles.

1. Real-space mesh techniques in density-functional theory

2. Construction of the Fock Matrix on a Grid-Based Molecular Orbital Basis Using GPGPUs

3. Configuration interaction singles based on the real-space numerical grid method: Kohn–Sham versus Hartree–Fock orbitals

4. Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems

5. A massively-parallel electronic-structure calculations based on real-space density functional theory

Cited by 7 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Gaussian-Approximated Poisson Preconditioner for Iterative Diagonalization in Real-Space Density Functional Theory;The Journal of Physical Chemistry A;2023-04-24

2. System-Specific Separable Basis Based on Tucker Decomposition: Application to Density Functional Calculations;Journal of Chemical Theory and Computation;2022-04-18

3. ACE-Molecule: An open-source real-space quantum chemistry package;The Journal of Chemical Physics;2020-03-31

4. Kohn–Sham approach for fast hybrid density functional calculations in real-space numerical grid methods;Computer Physics Communications;2018-09

5. A Generalized Grid-Based Fast Multipole Method for Integrating Helmholtz Kernels;Journal of Chemical Theory and Computation;2017-01-31

同舟云学术

1.学者识别学者识别

2.学术分析学术分析

3.人才评估人才评估

"同舟云学术"是以全球学者为主线，采集、加工和组织学术论文而形成的新型学术文献查询和分析系统，可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容，当前同舟云学术共收录了国内外主流学术期刊6万余种，收集的期刊论文及会议论文总量共计约1.5亿篇，并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询！咨询电话：010-8811{复制后删除}0370

www.globalauthorid.com

TOP

Copyright © 2019-2024 北京同舟云网络信息技术有限公司
京公网安备11010802033243号京ICP备18003416号-3