نتایج جستجو برای: calculations

تعداد نتایج: 111826  

Journal: :International Journal of Quantum Chemistry 2000

Journal: :Geophysical Journal International 1974

Journal: :The Journal of Risk and Insurance 1982

Journal: :Undergraduate Journal of Mathematical Modeling: One + Two 2013

Journal: :iranian chemical communication 2014
reza behjatmanesh negin safaeian

: in this work, different levels of theory containing hf, b3lyp, and mp2 with different basis sets such as 6-31g, 6-31g*, 6-311g, 6-311+g, 6-31+g*, 6-31+g are used to predict relative acidity constants of some aniline derivatives. three different kinds of radii containing uahf, bondi, and pauling are used to study how cavity forms change acidity constants. in all cases, dpcm model is used to si...

Journal: :Journal of Chemical Education 1986

Journal: :Journal of Chemical Education 1956

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