Density Functional Theory under the Bubbles and Cube Numerical Framework-Reference-Cited by-同舟云学术

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Density Functional Theory under the Bubbles and Cube Numerical Framework

Published:2018-06-26 Issue:8 Volume:14 Page:4237-4245
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Parkkinen Pauli¹^ORCID,Xu Wen-Hua¹²,Solala Eelis¹,Sundholm Dage¹³^ORCID

Affiliation:

1. Department of Chemistry, University of Helsinki, P.O. Box 55 (A. I. Virtanens plats 1), FIN-00014 Helsinki, Finland

2. College of Chemistry and Materials Science, Northwest University, Xi’an 710069, China

3. Centre for Advanced Study at the Norwegian Academy of Science and Letters, Drammensveien 78, N-0271 Oslo, Norway

Funder

Suomen Akatemia

Magnus Ehrnroothin S??ti?

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

http://pubs.acs.org/doi/pdf/10.1021/acs.jctc.8b00456

Reference47 articles.

1. Perspective: Fifty years of density-functional theory in chemical physics

2. Jacob’s ladder of density functional approximations for the exchange-correlation energy

3. Electronic wave functions - I. A general method of calculation for the stationary states of any molecular system

4. Magnetic properties with multiwavelets and DFT: the complete basis set limit achieved

5. The Elephant in the Room of Density Functional Theory Calculations

Cited by 4 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. Efficient All-Electron Time-Dependent Density Functional Theory Calculations Using an Enriched Finite Element Basis;Journal of Chemical Theory and Computation;2023-01-19

2. Computational Chemistry: The Exciting Opportunities and the Boring Details;Israel Journal of Chemistry;2021-06-14

3. A review on non‐relativistic, fully numerical electronic structure calculations on atoms and diatomic molecules;International Journal of Quantum Chemistry;2019-05-21

4. Probing Basis Set Requirements for Calculating Core Ionization and Core Excitation Spectroscopy by the Δ Self-Consistent-Field Approach;Journal of Chemical Theory and Computation;2018-11-29

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