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 *

380 related articles for article (PubMed ID: 27544083)

  • 1. Explicitly correlated coupled-cluster theory with Brueckner orbitals.
    Tew DP
    J Chem Phys; 2016 Aug; 145(7):074103. PubMed ID: 27544083
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Toward a W4-F12 approach: Can explicitly correlated and orbital-based ab initio CCSD(T) limits be reconciled?
    Sylvetsky N; Peterson KA; Karton A; Martin JM
    J Chem Phys; 2016 Jun; 144(21):214101. PubMed ID: 27276939
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Scalable Electron Correlation Methods. 8. Explicitly Correlated Open-Shell Coupled-Cluster with Pair Natural Orbitals PNO-RCCSD(T)-F12 and PNO-UCCSD(T)-F12.
    Ma Q; Werner HJ
    J Chem Theory Comput; 2021 Feb; 17(2):902-926. PubMed ID: 33405921
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Perturbative triples correction for local pair natural orbital based explicitly correlated CCSD(F12*) using Laplace transformation techniques.
    Schmitz G; Hättig C
    J Chem Phys; 2016 Dec; 145(23):234107. PubMed ID: 28010093
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Analytical energy gradients for explicitly correlated wave functions. II. Explicitly correlated coupled cluster singles and doubles with perturbative triples corrections: CCSD(T)-F12.
    Győrffy W; Werner HJ
    J Chem Phys; 2018 Mar; 148(11):114104. PubMed ID: 29566500
    [TBL] [Abstract][Full Text] [Related]  

  • 6. On the accuracy of explicitly correlated coupled-cluster interaction energies--have orbital results been beaten yet?
    Patkowski K
    J Chem Phys; 2012 Jul; 137(3):034103. PubMed ID: 22830679
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Scalable Electron Correlation Methods. 5. Parallel Perturbative Triples Correction for Explicitly Correlated Local Coupled Cluster with Pair Natural Orbitals.
    Ma Q; Werner HJ
    J Chem Theory Comput; 2018 Jan; 14(1):198-215. PubMed ID: 29211961
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Prediction of Reaction Barriers and Thermochemical Properties with Explicitly Correlated Coupled-Cluster Methods: A Basis Set Assessment.
    Zhang J; Valeev EF
    J Chem Theory Comput; 2012 Sep; 8(9):3175-86. PubMed ID: 26605729
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Simple coupled-cluster singles and doubles method with perturbative inclusion of triples and explicitly correlated geminals: The CCSD(T)R12 model.
    Valeev EF; Daniel Crawford T
    J Chem Phys; 2008 Jun; 128(24):244113. PubMed ID: 18601323
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Performance of Localized-Orbital Coupled-Cluster Approaches for the Conformational Energies of Longer
    Santra G; Martin JML
    J Phys Chem A; 2022 Dec; 126(50):9375-9391. PubMed ID: 36508714
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Explicitly correlated coupled cluster method for accurate treatment of open-shell molecules with hundreds of atoms.
    Kumar A; Neese F; Valeev EF
    J Chem Phys; 2020 Sep; 153(9):094105. PubMed ID: 32891102
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Variational formulation of perturbative explicitly-correlated coupled-cluster methods.
    Torheyden M; Valeev EF
    Phys Chem Chem Phys; 2008 Jun; 10(23):3410-20. PubMed ID: 18535724
    [TBL] [Abstract][Full Text] [Related]  

  • 13. The coupled cluster singles, doubles, and a hybrid treatment of connected triples based on the split virtual orbitals.
    Shen J; Kou Z; Xu E; Li S
    J Chem Phys; 2012 Jan; 136(4):044101. PubMed ID: 22299855
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Coupled-cluster method for open-shell heavy-element systems with spin-orbit coupling.
    Cao Z; Wang F; Yang M
    J Chem Phys; 2017 Apr; 146(13):134108. PubMed ID: 28390360
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Extrapolating MP2 and CCSD explicitly correlated correlation energies to the complete basis set limit with first and second row correlation consistent basis sets.
    Hill JG; Peterson KA; Knizia G; Werner HJ
    J Chem Phys; 2009 Nov; 131(19):194105. PubMed ID: 19929044
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Correlation consistent basis sets for explicitly correlated wavefunctions: pseudopotential-based basis sets for the post-d main group elements Ga-Rn.
    Hill JG; Peterson KA
    J Chem Phys; 2014 Sep; 141(9):094106. PubMed ID: 25194363
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Explicit correlation and intermolecular interactions: investigating carbon dioxide complexes with the CCSD(T)-F12 method.
    de Lange KM; Lane JR
    J Chem Phys; 2011 Jan; 134(3):034301. PubMed ID: 21261347
    [TBL] [Abstract][Full Text] [Related]  

  • 18. The coupled cluster approach with a hybrid treatment of connected triple excitations based on the restricted Hartree-Fock reference.
    Shen J; Kou Z; Xu E; Li S
    J Chem Phys; 2011 Jan; 134(4):044134. PubMed ID: 21280714
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Assessment of the accuracy of coupled cluster perturbation theory for open-shell systems. I. Triples expansions.
    Eriksen JJ; Matthews DA; Jørgensen P; Gauss J
    J Chem Phys; 2016 May; 144(19):194102. PubMed ID: 27208931
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Explicitly correlated coupled-cluster theory using cusp conditions. II. Treatment of connected triple excitations.
    Köhn A
    J Chem Phys; 2010 Nov; 133(17):174118. PubMed ID: 21054017
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 19.