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 *

163 related articles for article (PubMed ID: 16354051)

  • 1. Intermolecular potential of the O2-O2 dimer. An ab initio study and comparison with experiment.
    Hernández-Lamoneda R; Bartolomei M; Hernández MI; Campos-Martínez J; Dayou F
    J Phys Chem A; 2005 Dec; 109(50):11587-95. PubMed ID: 16354051
    [TBL] [Abstract][Full Text] [Related]  

  • 2. The intermolecular potentials of the O2-O2 dimer: a detailed ab initio study of the energy splittings for the three lowest multiplet states.
    Bartolomei M; Hernández MI; Campos-Martínez J; Carmona-Novillo E; Hernández-Lamoneda R
    Phys Chem Chem Phys; 2008 Sep; 10(35):5374-80. PubMed ID: 18766233
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Global ab initio potential energy surfaces for the O2(3Σg-)+O2(3Σg-) interaction.
    Bartolomei M; Carmona-Novillo E; Hernández MI; Campos-Martínez J; Hernández-Lamoneda R
    J Chem Phys; 2010 Sep; 133(12):124311. PubMed ID: 20886936
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Accurate ab initio intermolecular potential energy surface for the quintet state of the O2(3Sigma(g)-)-O2(3Sigma(g)-) dimer.
    Bartolomei M; Carmona-Novillo E; Hernández MI; Campos-Martínez J; Hernandez-Lamoneda R
    J Chem Phys; 2008 Jun; 128(21):214304. PubMed ID: 18537419
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Spin-orbit coupling in O2(upsilon)+O2 collisions: I. Electronic structure calculations on dimer states involving the X 3Sigmag-, a 1Deltag, and b 1Sigmag+ states of O2.
    Dayou F; Hernández MI; Campos-Martínez J; Hernández-Lamoneda R
    J Chem Phys; 2005 Aug; 123(7):074311. PubMed ID: 16229574
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Electronic structure and spin coupling of the manganese dimer: The state of the art of ab initio approach.
    Buchachenko AA; Chałasiński G; Szcześniak MM
    J Chem Phys; 2010 Jan; 132(2):024312. PubMed ID: 20095679
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Ab initio calculation of the NH(3sigma-)-NH(3sigma-) interaction potentials in the quintet, triplet, and singlet states.
    Dhont GS; van Lenthe JH; Groenenboom GC; van der Avoird A
    J Chem Phys; 2005 Nov; 123(18):184302. PubMed ID: 16292903
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Ab initio wavenumber accurate spectroscopy: 1CH2 and HCN vibrational levels on automatically generated IMLS potential energy surfaces.
    Dawes R; Wagner AF; Thompson DL
    J Phys Chem A; 2009 Apr; 113(16):4709-21. PubMed ID: 19371124
    [TBL] [Abstract][Full Text] [Related]  

  • 9. An analytical potential energy function to model protonated peptide soft-landing experiments. The CH3NH3+/CH4 interactions.
    Deb B; Hu W; Song K; Hase WL
    Phys Chem Chem Phys; 2008 Aug; 10(31):4565-72. PubMed ID: 18665306
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Ab initio and analytic intermolecular potentials for Ar-CH(3)OH.
    Tasić U; Alexeev Y; Vayner G; Crawford TD; Windus TL; Hase WL
    Phys Chem Chem Phys; 2006 Oct; 8(40):4678-84. PubMed ID: 17047766
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Ab initio calculations of the lowest electronic states in the CuNO system.
    Krishna BM; Marquardt R
    J Chem Phys; 2012 Jun; 136(24):244303. PubMed ID: 22755570
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Ab initio and analytic intermolecular potentials for Ar-CF4.
    Vayner G; Alexeev Y; Wang J; Windus TL; Hase WL
    J Phys Chem A; 2006 Mar; 110(9):3174-8. PubMed ID: 16509641
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Quantum-mechanical study of the collision dynamics of O2(3Sigma(g)-) + O2(3Sigma(g)-) on a new ab initio potential energy surface.
    Pérez-Ríos J; Bartolomei M; Campos-Martínez J; Hernández MI; Hernández-Lamoneda R
    J Phys Chem A; 2009 Dec; 113(52):14952-60. PubMed ID: 20028175
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Molecular dynamics simulations of fluid methane properties using ab initio intermolecular interaction potentials.
    Chao SW; Li AH; Chao SD
    J Comput Chem; 2009 Sep; 30(12):1839-49. PubMed ID: 19090563
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Potential energy surface for interactions between two hydrogen molecules.
    Patkowski K; Cencek W; Jankowski P; Szalewicz K; Mehl JB; Garberoglio G; Harvey AH
    J Chem Phys; 2008 Sep; 129(9):094304. PubMed ID: 19044867
    [TBL] [Abstract][Full Text] [Related]  

  • 16. The C2H3 + O2 reaction revisited: is multireference treatment of the wave function really critical?
    Mebel AM; Kislov VV
    J Phys Chem A; 2005 Aug; 109(32):6993-7. PubMed ID: 16834061
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Ab initio ground and excited state potential energy surfaces for NO-Kr complex and dynamics of Kr solids with NO impurity.
    Castro-Palacios JC; Rubayo-Soneira J; Ishii K; Yamashita K
    J Chem Phys; 2007 Apr; 126(13):134315. PubMed ID: 17430040
    [TBL] [Abstract][Full Text] [Related]  

  • 18. A diabatic representation including both valence nonadiabatic interactions and spin-orbit effects for reaction dynamics.
    Valero R; Truhlar DG
    J Phys Chem A; 2007 Sep; 111(35):8536-51. PubMed ID: 17691756
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Intermolecular potentials of the silane dimer calculated with Hartree-Fock theory, Møller-Plesset perturbation theory, and density functional theory.
    Pai CC; Li AH; Chao SD
    J Phys Chem A; 2007 Nov; 111(46):11922-9. PubMed ID: 17963367
    [TBL] [Abstract][Full Text] [Related]  

  • 20. An ab initio study of the Ar-NO(A 2Sigma+) intermolecular potential.
    Castro-Palacio JC; Ishii K; Rubayo-Soneira J; Yamashita K
    J Chem Phys; 2009 Jul; 131(4):044506. PubMed ID: 19655893
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.