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 *

148 related articles for article (PubMed ID: 27174253)

  • 1. Design of spin-forbidden transitions for polypyridyl metal complexes by time-dependent density functional theory including spin-orbit interaction.
    Kanno S; Imamura Y; Hada M
    Phys Chem Chem Phys; 2016 May; 18(21):14466-78. PubMed ID: 27174253
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Enhancing Near-Infrared Absorption in Terpyridyl Ru/Os Complexes with Ancillary Ligands to Activate Spin-Forbidden Transitions in Dye-Sensitized Solar Cells: A TDDFT Investigation.
    Juwita R; Liao JM; Chen CY; Tsai HG
    J Phys Chem A; 2024 Feb; 128(5):880-894. PubMed ID: 38271995
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Spin-Forbidden Transitions between Electronic States in the Active Site of Rubredoxin.
    dePolo GE; Kaliakin DS; Varganov SA
    J Phys Chem A; 2016 Nov; 120(43):8691-8698. PubMed ID: 27739682
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Spin-orbit relativistic long-range corrected time-dependent density functional theory for investigating spin-forbidden transitions in photochemical reactions.
    Nakata A; Tsuneda T; Hirao K
    J Chem Phys; 2011 Dec; 135(22):224106. PubMed ID: 22168679
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Spin-Forbidden Reactions: Adiabatic Transition States Using Spin-Orbit Coupled Density Functional Theory.
    Gaggioli CA; Belpassi L; Tarantelli F; Harvey JN; Belanzoni P
    Chemistry; 2018 Apr; 24(20):5006-5015. PubMed ID: 29088506
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Optical Activity of Spin-Forbidden Electronic Transitions in Metal Complexes from Time-Dependent Density Functional Theory with Spin-Orbit Coupling.
    Ludowieg HD; Srebro-Hooper M; Crassous J; Autschbach J
    ChemistryOpen; 2022 May; 11(5):e202200020. PubMed ID: 35585034
    [TBL] [Abstract][Full Text] [Related]  

  • 7. A combined DFT and restricted open-shell configuration interaction method including spin-orbit coupling: application to transition metal L-edge X-ray absorption spectroscopy.
    Roemelt M; Maganas D; DeBeer S; Neese F
    J Chem Phys; 2013 May; 138(20):204101. PubMed ID: 23742448
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Impact of Spin-Orbit Coupling on Photocurrent Generation in Ruthenium Dye-Sensitized Solar Cells.
    Fantacci S; Ronca E; De Angelis F
    J Phys Chem Lett; 2014 Jan; 5(2):375-80. PubMed ID: 26270714
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Element-specific characterization of transient electronic structure of solvated Fe(II) complexes with time-resolved soft X-ray absorption spectroscopy.
    Hong K; Cho H; Schoenlein RW; Kim TK; Huse N
    Acc Chem Res; 2015 Nov; 48(11):2957-66. PubMed ID: 26488127
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Effects of chain length and Au spin-orbit coupling on 3(pi pi*) emission from bridging Cn2- units: theoretical characterization of spin-forbidden radiative transitions in metal-capped one-dimensional carbon chains [H3PAu(C[triple bond]C)nAuPH3].
    Cao Z; Zhang Q
    Chemistry; 2004 Apr; 10(8):1920-5. PubMed ID: 15079831
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Fe L-edge X-ray absorption spectra of Fe(II) polypyridyl spin crossover complexes from time-dependent density functional theory.
    Hua W; Tian G; Fronzoni G; Li X; Stener M; Luo Y
    J Phys Chem A; 2013 Dec; 117(51):14075-85. PubMed ID: 24283347
    [TBL] [Abstract][Full Text] [Related]  

  • 12. The direct role of nuclear motion in spin-orbit coupling in strongly correlated spin systems.
    Willatt MJ; Alavi A
    J Chem Phys; 2024 Jun; 160(23):. PubMed ID: 38884397
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Theoretical studies on the absorption spectra of cis-[Ru(4,4'-COO-2,2'-bpy)2(X)2](4-), (X = NCS, Cl) and panchromatic trans-terpyridyl Ru complexes including strong spin-orbit coupling.
    Mishima K; Kinoshita T; Hayashi M; Jono R; Segawa H; Yamashita K; Lin SH
    Phys Chem Chem Phys; 2015 May; 17(18):12317-27. PubMed ID: 25896092
    [TBL] [Abstract][Full Text] [Related]  

  • 14. A computational protocol for the study of circularly polarized phosphorescence and circular dichroism in spin-forbidden absorption.
    Kamiński M; Cukras J; Pecul M; Rizzo A; Coriani S
    Phys Chem Chem Phys; 2015 Jul; 17(29):19079-86. PubMed ID: 26126575
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Spin-forbidden and spin-enabled 4f(14)-->4f(13)5d(1) transitions of Yb(2+)-doped CsCaBr3.
    Sánchez-Sanz G; Seijo L; Barandiarán Z
    J Chem Phys; 2009 Jul; 131(2):024505. PubMed ID: 19604002
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Triplet-Singlet Emission of d-Block Metal Complexes Characterized by Spin-Orbit Natural Transition Orbitals.
    Zaichenko A; Autschbach J
    ChemistryOpen; 2024 Mar; ():e202300291. PubMed ID: 38441492
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Spin-Orbit Natural Transition Orbitals and Spin-Forbidden Transitions.
    Feng R; Yu X; Autschbach J
    J Chem Theory Comput; 2021 Dec; 17(12):7531-7544. PubMed ID: 34792327
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Spin-State Energetics of Fe(III) and Ru(III) Aqua Complexes: Accurate ab Initio Calculations and Evidence for Huge Solvation Effects.
    Radoń M; Gąssowska K; Szklarzewicz J; Broclawik E
    J Chem Theory Comput; 2016 Apr; 12(4):1592-605. PubMed ID: 26990105
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Surface hopping trajectory simulations with spin-orbit and dynamical couplings.
    Granucci G; Persico M; Spighi G
    J Chem Phys; 2012 Dec; 137(22):22A501. PubMed ID: 23249038
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Mechanism of NO photodissociation in photolabile manganese-NO complexes with pentadentate N5 ligands.
    Merkle AC; Fry NL; Mascharak PK; Lehnert N
    Inorg Chem; 2011 Dec; 50(23):12192-203. PubMed ID: 22040173
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 8.