Literature DB >> 27554405

Density functional theory: Fixing Jacob's ladder.

Roberto Car1.   

Abstract

Year:  2016        PMID： 27554405     DOI： 10.1038/nchem.2605

Source DB:  PubMed          Journal:  Nat Chem        ISSN： 1755-4330            Impact factor:   24.427


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  1 in total

1.  Accurate first-principles structures and energies of diversely bonded systems from an efficient density functional.

Authors:  Jianwei Sun; Richard C Remsing; Yubo Zhang; Zhaoru Sun; Adrienn Ruzsinszky; Haowei Peng; Zenghui Yang; Arpita Paul; Umesh Waghmare; Xifan Wu; Michael L Klein; John P Perdew
Journal:  Nat Chem       Date:  2016-06-13       Impact factor: 24.427
  1 in total
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Review 1.  Dynamics & Spectroscopy with Neutrons-Recent Developments & Emerging Opportunities.

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Journal:  Polymers (Basel)       Date:  2021-04-29       Impact factor: 4.329

2.  Origin of band gaps in 3d perovskite oxides.

Authors:  Julien Varignon; Manuel Bibes; Alex Zunger
Journal:  Nat Commun       Date:  2019-04-10       Impact factor: 14.919

3.  Computational Study on Homolytic Bond Energies of the Ag-X (X = C, O, and H) Complexes and Hammett-Type Analysis of Reactivity.

Authors:  Lei Wu; Shi-Ya Tang; Shaodong Zhou
Journal:  ACS Omega       Date:  2021-12-07
  3 in total

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