These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

121 related articles for article (PubMed ID: 37861115)

  • 1. The electron-centric approach to the exchange-correlation energy.
    Roy PO; Henkes T; Ernzerhof M
    J Chem Phys; 2023 Oct; 159(15):. PubMed ID: 37861115
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Constructing and representing exchange-correlation holes through artificial neural networks.
    Cuierrier E; Roy PO; Ernzerhof M
    J Chem Phys; 2021 Nov; 155(17):174121. PubMed ID: 34742211
    [TBL] [Abstract][Full Text] [Related]  

  • 3. The Predictive Power of Exact Constraints and Appropriate Norms in Density Functional Theory.
    Kaplan AD; Levy M; Perdew JP
    Annu Rev Phys Chem; 2023 Apr; 74():193-218. PubMed ID: 36696591
    [TBL] [Abstract][Full Text] [Related]  

  • 4. The correlation factor approach: Combining density functional and wave function theory.
    Roy PO; Cuierrier É; Ernzerhof M
    J Chem Phys; 2020 Jun; 152(21):211101. PubMed ID: 32505142
    [TBL] [Abstract][Full Text] [Related]  

  • 5. The factorization ansatz for non-local approximations to the exchange-correlation hole.
    Cuierrier E; Roy PO; Ernzerhof M
    J Chem Phys; 2022 May; 156(18):184110. PubMed ID: 35568557
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Some Fundamental Issues in Ground-State Density Functional Theory: A Guide for the Perplexed.
    Perdew JP; Ruzsinszky A; Constantin LA; Sun J; Csonka GI
    J Chem Theory Comput; 2009 Apr; 5(4):902-8. PubMed ID: 26609599
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Capturing the electron-electron cusp with the coupling-constant averaged exchange-correlation hole: A case study for Hooke's atoms.
    Hou L; Irons TJP; Wang Y; Furness JW; Wibowo-Teale AM; Sun J
    J Chem Phys; 2024 Jan; 160(1):. PubMed ID: 38180252
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Multiconfiguration Pair-Density Functional Theory: A New Way To Treat Strongly Correlated Systems.
    Gagliardi L; Truhlar DG; Li Manni G; Carlson RK; Hoyer CE; Bao JL
    Acc Chem Res; 2017 Jan; 50(1):66-73. PubMed ID: 28001359
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Importance of finite-temperature exchange correlation for warm dense matter calculations.
    Karasiev VV; Calderín L; Trickey SB
    Phys Rev E; 2016 Jun; 93(6):063207. PubMed ID: 27415377
    [TBL] [Abstract][Full Text] [Related]  

  • 10. From Kohn-Sham to Many-Electron Energies via Step Structures in the Exchange-Correlation Potential.
    Kraisler E; Hodgson MJP; Gross EKU
    J Chem Theory Comput; 2021 Mar; 17(3):1390-1407. PubMed ID: 33595312
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Time-dependent density functional study of the electronic potential energy curves and excitation spectrum of the oxygen molecule.
    Guan J; Wang F; Ziegler T; Cox H
    J Chem Phys; 2006 Jul; 125(4):44314. PubMed ID: 16942149
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Embedded Cluster Density Approximation for Exchange-Correlation Energy: A Natural Extension of the Local Density Approximation.
    Huang C
    J Chem Theory Comput; 2018 Dec; 14(12):6211-6225. PubMed ID: 30380864
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Quantal density functional theory of the hydrogen molecule.
    Pan XY; Sahni V
    J Chem Phys; 2004 Mar; 120(12):5642-9. PubMed ID: 15267441
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Time-dependent density-functional theory beyond the adiabatic approximation: insights from a two-electron model system.
    Ullrich CA
    J Chem Phys; 2006 Dec; 125(23):234108. PubMed ID: 17190548
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Adiabatic connection for strictly correlated electrons.
    Liu ZF; Burke K
    J Chem Phys; 2009 Sep; 131(12):124124. PubMed ID: 19791869
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Ground-state energy as a simple sum of orbital energies in Kohn-Sham theory: a shift in perspective through a shift in potential.
    Levy M; Zahariev F
    Phys Rev Lett; 2014 Sep; 113(11):113002. PubMed ID: 25259974
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Scaled σ-functionals for the Kohn-Sham correlation energy with scaling functions from the homogeneous electron gas.
    Erhard J; Fauser S; Trushin E; Görling A
    J Chem Phys; 2022 Sep; 157(11):114105. PubMed ID: 36137780
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Spin-state dependence of exchange-correlation holes.
    Brüggemann J; Jacob CR
    Faraday Discuss; 2020 Dec; 224(0):56-78. PubMed ID: 32914802
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Efficient Embedded Cluster Density Approximation Calculations with an Orbital-Free Treatment of Environments.
    Chi YC; Shaban Tameh M; Huang C
    J Chem Theory Comput; 2021 May; 17(5):2737-2751. PubMed ID: 33856795
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Orbital energies and negative electron affinities from density functional theory: Insight from the integer discontinuity.
    Teale AM; De Proft F; Tozer DJ
    J Chem Phys; 2008 Jul; 129(4):044110. PubMed ID: 18681637
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 7.