Even Faster Exact Exchange for Solids via Tensor Hypercontraction-Reference-Cited by-同舟云学术

登录注册会员服务联系我们

Even Faster Exact Exchange for Solids via Tensor Hypercontraction

Published:2023-08-16 Issue:17 Volume:19 Page:5773-5784
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Rettig Adam¹²^ORCID,Lee Joonho³^ORCID,Head-Gordon Martin¹²^ORCID

Affiliation:

1. Department of Chemistry, University of California, Berkeley, California 94720, United States

2. Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States

3. Department of Chemistry, Columbia University, New York, New York 10027, United States

Funder

Basic Energy Sciences

Division of Graduate Education

National Institute of General Medical Sciences

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c00407

Reference77 articles.

1. Thirty years of density functional theory in computational chemistry: an overview and extensive assessment of 200 density functionals

2. A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions

3. Comprehensive Thermochemical Benchmark Set of Realistic Closed-Shell Metal Organic Reactions

4. Assessment of DFT Methods for Transition Metals with the TMC151 Compilation of Data Sets and Comparison with Accuracies for Main-Group Chemistry

5. On the prediction of band gaps from hybrid functional theory

Cited by 6 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. Equivariant Neural Networks Utilizing Molecular Clusters for Accurate Molecular Crystal Lattice Energy Predictions;ACS Omega;2024-09-11

2. Use of Multigrids to Reduce the Cost of Performing Interpolative Separable Density Fitting;The Journal of Physical Chemistry A;2024-08-26

3. Tucker Tensor Approach for Accelerating Fock Exchange Computations in a Real-Space Finite-Element Discretization of Generalized Kohn–Sham Density Functional Theory;Journal of Chemical Theory and Computation;2024-04-25

4. Low-Scaling Algorithms for GW and Constrained Random Phase Approximation Using Symmetry-Adapted Interpolative Separable Density Fitting;Journal of Chemical Theory and Computation;2024-04-10

5. Efficient periodic resolution-of-the-identity Hartree–Fock exchange method with k-point sampling and Gaussian basis sets;The Journal of Chemical Physics;2024-02-14

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