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179 related items for PubMed ID: 23701185
1. Thermal boundary conductance and thermal rectification in molecules. Leitner DM. J Phys Chem B; 2013 Oct 24; 117(42):12820-8. PubMed ID: 23701185 [Abstract] [Full Text] [Related]
2. Molecular dynamics simulation of heat conduction through a molecular chain. Schröder C, Vikhrenko V, Schwarzer D. J Phys Chem A; 2009 Dec 24; 113(51):14039-51. PubMed ID: 19928969 [Abstract] [Full Text] [Related]
5. Anharmonic force constants extracted from first-principles molecular dynamics: applications to heat transfer simulations. Tadano T, Gohda Y, Tsuneyuki S. J Phys Condens Matter; 2014 Jun 04; 26(22):225402. PubMed ID: 24824156 [Abstract] [Full Text] [Related]
13. Vibrational spectroscopy of protonated imidazole and its complexes with water molecules: ab initio anharmonic calculations and experiments. Adesokan AA, Chaban GM, Dopfer O, Gerber RB. J Phys Chem A; 2007 Aug 09; 111(31):7374-81. PubMed ID: 17500546 [Abstract] [Full Text] [Related]
14. Vibrational energy flow through the green fluorescent protein-water interface: communication maps and thermal boundary conductance. Xu Y, Leitner DM. J Phys Chem B; 2014 Jul 17; 118(28):7818-26. PubMed ID: 24471982 [Abstract] [Full Text] [Related]
17. Thermal conduction in molecular materials using coarse grain dynamics: role of mass diffusion and quantum corrections for molecular dynamics simulations. Zhou Y, Strachan A. J Chem Phys; 2009 Dec 21; 131(23):234113. PubMed ID: 20025320 [Abstract] [Full Text] [Related]