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.
298 related articles for article (PubMed ID: 17034229)
1. Diffusion dynamics of the li atom on amorphous carbon: A direct molecular orbital-molecular dynamics study. Tachikawa H; Shimizu A J Phys Chem B; 2006 Oct; 110(41):20445-50. PubMed ID: 17034229 [TBL] [Abstract][Full Text] [Related]
2. Diffusion dynamics of the Li+ ion on a model surface of amorphous carbon: a direct molecular orbital dynamics study. Tachikawa H; Shimizu A J Phys Chem B; 2005 Jul; 109(27):13255-62. PubMed ID: 16852653 [TBL] [Abstract][Full Text] [Related]
3. Hydration of Li+ -ion in atom-bond electronegativity equalization method-7P water: a molecular dynamics simulation study. Li X; Yang ZZ J Chem Phys; 2005 Feb; 122(8):84514. PubMed ID: 15836070 [TBL] [Abstract][Full Text] [Related]
4. Quantum dynamics of an excited alkali atom in a noble gas cluster: lithium attached to a helium cluster. Pacheco AB; Thorndyke B; Reyes A; Micha DA J Chem Phys; 2007 Dec; 127(24):244504. PubMed ID: 18163688 [TBL] [Abstract][Full Text] [Related]
5. Penning ionization electron spectroscopy of C6H6 by collision with He*(2 3 S) metastable atoms and classical trajectory calculations: optimization of ab initio model potentials. Yamazaki M; Maeda S; Kishimoto N; Ohno K J Chem Phys; 2005 Jan; 122(4):44303. PubMed ID: 15740244 [TBL] [Abstract][Full Text] [Related]
6. Theoretical study of the stability of lithium atoms in alpha-rhombohedral boron. Hayami W; Tanaka T; Otani S J Phys Chem A; 2005 Dec; 109(51):11975-9. PubMed ID: 16366651 [TBL] [Abstract][Full Text] [Related]
7. Separation of time scale and coupling in the motion governed by the coarse-grained and fine degrees of freedom in a polypeptide backbone. Murarka RK; Liwo A; Scheraga HA J Chem Phys; 2007 Oct; 127(15):155103. PubMed ID: 17949219 [TBL] [Abstract][Full Text] [Related]
8. Reaction dynamics following electron capture of chlorofluorocarbon adsorbed on water cluster: a direct density functional theory molecular dynamics study. Tachikawa H; Abe S J Chem Phys; 2007 May; 126(19):194310. PubMed ID: 17523807 [TBL] [Abstract][Full Text] [Related]
9. Formation and structural anomaly of the metastable phases in an immiscible Ag-Mo system studied by ion beam mixing and molecular dynamics simulation. Tai KP; Dai XD; Shen YX; Liu BX J Phys Chem B; 2006 Jan; 110(1):595-606. PubMed ID: 16471572 [TBL] [Abstract][Full Text] [Related]
10. Molecular dynamics simulation of dense carbon dioxide fluid on amorphous silica surfaces. Yang X; Xu Z; Zhang C J Colloid Interface Sci; 2006 May; 297(1):38-44. PubMed ID: 16325840 [TBL] [Abstract][Full Text] [Related]
11. Diffusion coefficients of small gas molecules in amorphous cis-1,4-polybutadiene estimated by molecular dynamics simulations. Meunier M J Chem Phys; 2005 Oct; 123(13):134906. PubMed ID: 16223330 [TBL] [Abstract][Full Text] [Related]
12. Structure and dynamics of S3(-) radicals in ultramarine-type pigment based on zeolite A: electron spin resonance and electron spin echo studies. Goslar J; Lijewski S; Hoffmann SK; Jankowska A; Kowalak S J Chem Phys; 2009 May; 130(20):204504. PubMed ID: 19485454 [TBL] [Abstract][Full Text] [Related]
13. Electron hydration dynamics in water clusters: A direct ab initio molecular dynamics approach. Tachikawa H J Chem Phys; 2006 Oct; 125(14):144307. PubMed ID: 17042590 [TBL] [Abstract][Full Text] [Related]
14. Anisotropic diffusion of n-butane and n-decane on a stepped metal surface. Subramanian S; Wang JC J Chem Phys; 2005 Jul; 123(1):014706. PubMed ID: 16035862 [TBL] [Abstract][Full Text] [Related]
15. Oxygen vacancy formation for transient structures on the CeO2(110) surface at 300 and 750 K. Herschend B; Baudin M; Hermansson K J Chem Phys; 2007 Jun; 126(23):234706. PubMed ID: 17600434 [TBL] [Abstract][Full Text] [Related]
16. Atomic oxygen recombination on quartz at high temperature: experiments and molecular dynamics simulation. Bedra L; Rutigliano M; Balat-Pichelin M; Cacciatore M Langmuir; 2006 Aug; 22(17):7208-16. PubMed ID: 16893217 [TBL] [Abstract][Full Text] [Related]
17. Microscopic solvation of a lithium atom in water-ammonia mixed clusters: solvent coordination and electron localization in presence of a counterion. Pratihar S; Chandra A J Chem Phys; 2008 Jul; 129(2):024511. PubMed ID: 18624542 [TBL] [Abstract][Full Text] [Related]
18. Intramolecular SN2 reaction caused by photoionization of benzene chloride-NH3 complex: direct ab initio molecular dynamics study. Tachikawa H J Phys Chem A; 2006 Jan; 110(1):153-9. PubMed ID: 16392850 [TBL] [Abstract][Full Text] [Related]
19. 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]
20. Validation of intermolecular pair potential model of SiH4: molecular-dynamics simulation for saturated liquid density and thermal transport properties. Sakiyama Y; Takagi S; Matsumoto Y J Chem Phys; 2005 Jun; 122(23):234501. PubMed ID: 16008456 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]