نتایج جستجو برای: natural frequencyoptimization

تعداد نتایج: 481686  

Journal: :pollution 2015
nisar ahmad mohamad jaafar mohammed alsaffar

a study on natural radioactivity in virgin and agricultural soil samples collected from sungai petani was conducted using high-purity germanium. the mean activity concentrations of 226ra, 232th, and 40k in virgin soils were 51.06±5.83, 78.44±6.42, and 125.66±7.26 bq kg−1, respectively, while those in agricultural soils were 80.63±5.78, 116.87±7.87, and 200.66±18.24 bq kg−1, respectively. the co...

Journal: :journal of physical and theoretical chemistry 0
masoome sheikhi young researchers and elite club, gorgan branch, islamic azad university, gorgan, iran ebrahim balali department of pharmaceutical chemistry, faculty of pharmaceutical chemistry, pharmaceutical sciences branch, islamic azad university, tehran, iran hadi lari department of chemistry, mashhad branch, islamic azad university, mashhad, iran

the n-(2-benzoyl-phenyl) oxalyl derivatives are important models for studying of three-centered intramolecular hydrogen bonding in organic molecules. the quantum theoretical calculations for two crystal structures of n-(2-benzoyl-phenyl) oxalyl (compounds i and ii) were performed by density functional theory (b3lyp method and 6-311+g* basis set). from the optimized structures, geometric paramet...

Journal: :Journal of Computer and System Sciences 1997

Journal: :Journal of the American Chemical Society 1914

Journal: :Physics Letters B 2001

Journal: :Kobunshi 1966

Journal: :Nature 1884

Journal: :Journal of Japan Oil Chemists' Society 1970

Journal: :Revista CPC 2018

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