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 *

231 related articles for article (PubMed ID: 29928804)

  • 1. Linear-Response Density Cumulant Theory for Excited Electronic States.
    Copan AV; Sokolov AY
    J Chem Theory Comput; 2018 Aug; 14(8):4097-4108. PubMed ID: 29928804
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Simulating X-ray Absorption Spectra with Linear-Response Density Cumulant Theory.
    Peng R; Copan AV; Sokolov AY
    J Phys Chem A; 2019 Mar; 123(9):1840-1850. PubMed ID: 30742431
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Targeting Doubly Excited States with Equation of Motion Coupled Cluster Theory Restricted to Double Excitations.
    Boguslawski K
    J Chem Theory Comput; 2019 Jan; 15(1):18-24. PubMed ID: 30525613
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Characterization of singlet ground and low-lying electronic excited states of phosphaethyne and isophosphaethyne.
    Ingels JB; Turney JM; Richardson NA; Yamaguchi Y; Schaefer HF
    J Chem Phys; 2006 Sep; 125(10):104306. PubMed ID: 16999525
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Pushing the Limits of EOM-CCSD with Projector-Based Embedding for Excitation Energies.
    Bennie SJ; Curchod BFE; Manby FR; Glowacki DR
    J Phys Chem Lett; 2017 Nov; 8(22):5559-5565. PubMed ID: 29076727
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Application of equation-of-motion coupled-cluster methods to low-lying singlet and triplet electronic states of HBO and BOH.
    DeYonker NJ; Li S; Yamaguchi Y; Schaefer HF; Crawford TD; King RA; Peterson KA
    J Chem Phys; 2005 Jun; 122(23):234316. PubMed ID: 16008450
    [TBL] [Abstract][Full Text] [Related]  

  • 7. An EOM-CCSD-PCM Benchmark for Electronic Excitation Energies of Solvated Molecules.
    Ren S; Harms J; Caricato M
    J Chem Theory Comput; 2017 Jan; 13(1):117-124. PubMed ID: 27973775
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Can density cumulant functional theory describe static correlation effects?
    Mullinax JW; Sokolov AY; Schaefer HF
    J Chem Theory Comput; 2015 Jun; 11(6):2487-95. PubMed ID: 26575548
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Benchmarking Coupled Cluster Methods on Valence Singlet Excited States.
    Kánnár D; Szalay PG
    J Chem Theory Comput; 2014 Sep; 10(9):3757-65. PubMed ID: 26588520
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Critical Assessment of TD-DFT for Excited States of Open-Shell Systems: I. Doublet-Doublet Transitions.
    Li Z; Liu W
    J Chem Theory Comput; 2016 Jan; 12(1):238-60. PubMed ID: 26672389
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Reference Energies for Double Excitations.
    Loos PF; Boggio-Pasqua M; Scemama A; Caffarel M; Jacquemin D
    J Chem Theory Comput; 2019 Mar; 15(3):1939-1956. PubMed ID: 30689951
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Assessment of low-scaling approximations to the equation of motion coupled-cluster singles and doubles equations.
    Goings JJ; Caricato M; Frisch MJ; Li X
    J Chem Phys; 2014 Oct; 141(16):164116. PubMed ID: 25362281
    [TBL] [Abstract][Full Text] [Related]  

  • 13. A Mountaineering Strategy to Excited States: Highly Accurate Energies and Benchmarks for Medium Sized Molecules.
    Loos PF; Lipparini F; Boggio-Pasqua M; Scemama A; Jacquemin D
    J Chem Theory Comput; 2020 Mar; 16(3):1711-1741. PubMed ID: 31986042
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Spin-orbit couplings within the equation-of-motion coupled-cluster framework: Theory, implementation, and benchmark calculations.
    Epifanovsky E; Klein K; Stopkowicz S; Gauss J; Krylov AI
    J Chem Phys; 2015 Aug; 143(6):064102. PubMed ID: 26277122
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Different equation-of-motion coupled cluster methods with different reference functions: the formyl radical.
    Kuś T; Bartlett RJ
    J Chem Phys; 2008 Sep; 129(10):104301. PubMed ID: 19044907
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Theory, implementation, and disappointing results for two-photon absorption cross sections within the doubly electron-attached equation-of-motion coupled-cluster framework.
    Nanda KD; Gulania S; Krylov AI
    J Chem Phys; 2023 Feb; 158(5):054102. PubMed ID: 36754800
    [TBL] [Abstract][Full Text] [Related]  

  • 17. A new electronic structure method for doublet states: configuration interaction in the space of ionized 1h and 2h1p determinants.
    Golubeva AA; Pieniazek PA; Krylov AI
    J Chem Phys; 2009 Mar; 130(12):124113. PubMed ID: 19334814
    [TBL] [Abstract][Full Text] [Related]  

  • 18. A multireference coupled-cluster study of electronic excitations in furan and pyrrole.
    Li X; Paldus J
    J Phys Chem A; 2010 Aug; 114(33):8591-600. PubMed ID: 20155956
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Quantum chemical study of the electronic structure of NiCH2 + in its ground state and low-lying electronic excited states.
    Villaume S; Daniel C; Strich A; Perera SA; Bartlett RJ
    J Chem Phys; 2005 Jan; 122(4):44313. PubMed ID: 15740254
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Improving upon the accuracy for doubly excited states within the coupled cluster singles and doubles theory.
    Kuś T; Bartlett RJ
    J Chem Phys; 2009 Sep; 131(12):124310. PubMed ID: 19791884
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 12.