Exact Classical-Mechanical Calculation of the Translational-Vibrational Energy Transfer of Energized Anharmonic Diatomic Molecules

Calculation of anharmonic vibrational spectroscopy of small biological molecules

R. B. Gerber,* B. Brauer, S. K. Gregurick and G. M. Chaban Department of Physical Chemistry and Fritz Haber Research Center, The Hebrew University, Jerusalem 91904, Israel Department of Chemistry, University of California, Irvine, CA 92697, USA Department of Chemistry and Biochemistry, University of Maryland, Baltimore County, Baltimore, MD 20215, USA NASA Ames Research Center, Moffet Field, CA...

Progress towards the Accurate Calculation of Anharmonic Vibrational States of Flux- Ional Molecules and Clusters without a Potential Energy Surface

Anharmonic Algebraic Model of Thermodynamic Properties of Diatomic Molecules

An algebraic model based on Lie-algebraic techniques is applied to the analysis of thermodynamic vibrational properties of diatomic molecules. The local anharmonic effects are described by a Morse-like potential and corresponding anharmonic bosons associated with the U(2) algebra. A vibrational high temperature partition function and the related thermodynamic functions are derived in terms of t...

the effect of consciousness raising (c-r) on the reduction of translational errors: a case study

در دوره های آموزش ترجمه استادان بیشتر سعی دارند دانشجویان را با انواع متون آشنا سازند، درحالی که کمتر به خطاهای مکرر آنان در متن ترجمه شده می پردازند. اهمیت تحقیق حاضر مبنی بر ارتکاب مکرر خطاهای ترجمانی حتی بعد از گذراندن دوره های تخصصی ترجمه از سوی دانشجویان است. هدف از آن تاکید بر خطاهای رایج میان دانشجویان مترجمی و کاهش این خطاها با افزایش آگاهی و هوشیاری دانشجویان از بروز آنها است.از آنجا ک...

Experimental Vibrational Zero-Point Energies: Diatomic Molecules

Vibrational zero-point energies ZPEs , as determined from published spectroscopic constants, are derived for 85 diatomic molecules. Standard uncertainties are also provided, including estimated contributions from bias as well as the statistical uncertainties propagated from those reported in the spectroscopy literature. This compilation will be helpful for validating theoretical procedures for ...