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 *

1076 related articles for article (PubMed ID: 19425770)

  • 1. Full-dimensional ab initio potential energy surface and vibrational configuration interaction calculations for vinyl.
    Sharma AR; Braams BJ; Carter S; Shepler BC; Bowman JM
    J Chem Phys; 2009 May; 130(17):174301. PubMed ID: 19425770
    [TBL] [Abstract][Full Text] [Related]  

  • 2. An ab initio based global potential energy surface describing CH5+ --> CH3+ + H2.
    Jin Z; Braams BJ; Bowman JM
    J Phys Chem A; 2006 Feb; 110(4):1569-74. PubMed ID: 16435818
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Potential energy surface and MULTIMODE vibrational analysis of C2H3+.
    Sharma AR; Wu J; Braams BJ; Carter S; Schneider R; Shepler B; Bowman JM
    J Chem Phys; 2006 Dec; 125(22):224306. PubMed ID: 17176140
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Ab initio potential energy and dipole moment surfaces for H5O2 +.
    Huang X; Braams BJ; Bowman JM
    J Chem Phys; 2005 Jan; 122(4):44308. PubMed ID: 15740249
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Direct ab initio dynamics study on the rate constants and kinetics isotope effects of CH(3)O+H-->CH(2)O+H(2) reaction.
    Li QS; Zhang Y; Zhang S
    J Chem Phys; 2004 Nov; 121(19):9474-80. PubMed ID: 15538868
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Quantum and classical studies of vibrational motion of CH5+ on a global potential energy surface obtained from a novel ab initio direct dynamics approach.
    Brown A; McCoy AB; Braams BJ; Jin Z; Bowman JM
    J Chem Phys; 2004 Sep; 121(9):4105-16. PubMed ID: 15332956
    [TBL] [Abstract][Full Text] [Related]  

  • 7. 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]  

  • 8. Photodissociation of methane: exploring potential energy surfaces.
    van Harrevelt R
    J Chem Phys; 2006 Sep; 125(12):124302. PubMed ID: 17014169
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Quasiclassical trajectory calculations of acetaldehyde dissociation on a global potential energy surface indicate significant non-transition state dynamics.
    Shepler BC; Braams BJ; Bowman JM
    J Phys Chem A; 2007 Aug; 111(34):8282-5. PubMed ID: 17676724
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Ab initio potential energy and dipole moment surfaces of (H2O)2.
    Huang X; Braams BJ; Bowman JM
    J Phys Chem A; 2006 Jan; 110(2):445-51. PubMed ID: 16405316
    [TBL] [Abstract][Full Text] [Related]  

  • 11. MULTIMODE quantum calculations of intramolecular vibrational energies of the water dimer and trimer using ab initio-based potential energy surfaces.
    Wang Y; Carter S; Braams BJ; Bowman JM
    J Chem Phys; 2008 Feb; 128(7):071101. PubMed ID: 18298132
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Ab initio intermolecular potential energy surfaces of the water-rare gas atom complexes.
    Makarewicz J
    J Chem Phys; 2008 Nov; 129(18):184310. PubMed ID: 19045406
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Full-dimensional quantum calculations of ground-state tunneling splitting of malonaldehyde using an accurate ab initio potential energy surface.
    Wang Y; Braams BJ; Bowman JM; Carter S; Tew DP
    J Chem Phys; 2008 Jun; 128(22):224314. PubMed ID: 18554020
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Ab initio molecular-orbital study of structures and energetics of Si3H3 neutral and anion.
    Saitoh T; Naoe T; Ikuta S
    J Chem Phys; 2005 May; 122(20):204314. PubMed ID: 15945731
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Accurate ab initio and "hybrid" potential energy surfaces, intramolecular vibrational energies, and classical ir spectrum of the water dimer.
    Shank A; Wang Y; Kaledin A; Braams BJ; Bowman JM
    J Chem Phys; 2009 Apr; 130(14):144314. PubMed ID: 19368452
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Accurate ab initio potential energy surface, dynamics, and thermochemistry of the F+CH4-->HF+CH3 reaction.
    Czakó G; Shepler BC; Braams BJ; Bowman JM
    J Chem Phys; 2009 Feb; 130(8):084301. PubMed ID: 19256605
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Structures and energetics of H(6)(+) clusters.
    Hao Q; Simmonett AC; Yamaguchi Y; Fang DC; Schaefer HF
    J Phys Chem A; 2009 Dec; 113(48):13608-20. PubMed ID: 19852448
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Accurate ab initio structure, dissociation energy, and vibrational spectroscopy of the F(-)-CH4 anion complex.
    Czakó G; Braams BJ; Bowman JM
    J Phys Chem A; 2008 Aug; 112(32):7466-72. PubMed ID: 18651724
    [TBL] [Abstract][Full Text] [Related]  

  • 19. New ab initio potential energy surface and the vibration-rotation-tunneling levels of (H2O)2 and (D2O)2.
    Huang X; Braams BJ; Bowman JM; Kelly RE; Tennyson J; Groenenboom GC; van der Avoird A
    J Chem Phys; 2008 Jan; 128(3):034312. PubMed ID: 18205503
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Photochemical reactions of the low-lying excited states of formaldehyde: T1/S0 intersystem crossings, characteristics of the S1 and T1 potential energy surfaces, and a global T1 potential energy surface.
    Zhang P; Maeda S; Morokuma K; Braams BJ
    J Chem Phys; 2009 Mar; 130(11):114304. PubMed ID: 19317536
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 54.