نتایج جستجو برای: energy modelingat first

تعداد نتایج: 2025576  

ژورنال: انرژی ایران 2020

The importance of energy in the sustainable development of societies and its role in the economic, social and political relations of today's world is indisputable. The availability and proper use of energy resources ensures the full development of any country. Because of the importance of this issue, the topic of energy literacy was introduced in science education in the recent years. Textbooks...

Journal: :The journal of physical chemistry. A 2013
Chirantha P Rodrigo Chuanchuan Zhou Hanna Reisler

The photodissociation dynamics of the hydroxymethyl radical (CH2OH, CH2OD, and CD2OD) following excitation to the 3s and 3p(x) Rydberg states is studied using time-sliced velocity map imaging of hydrogen photofragments. Dissociation takes place on the ground potential energy surface reached via conical intersections from the excited states, and formaldehyde and hydrxymethylene are identified as...

Journal: :The Journal of Chemical Physics 1965

2001
J M COMBES P D HISLOP FRÉDÉRIC KLOPP SHU NAKAMURA

The integrated density of states (IDS) for random operators is an important function describing many physical characteristics of a random system. Properties of the IDS are derived from the Wegner estimate that describes the influence of finite-volume perturbations on a background system. In this paper, we present a simple proof of the Wegner estimate applicable to a wide variety of random pertu...

Journal: :Clean Technologies and Environmental Policy 2019

پایان نامه :وزارت علوم، تحقیقات و فناوری - دانشگاه لرستان - دانشکده علوم پایه 1393

در این تحقیق اثر الکترونگاتیوی برای استخلاف های f, cl, no2 , cf3 برروی آروماتیسیته مولکول بنزن مورد مطالعه قرار گرفته است. nics, ase, homa, homo-lumo energy gapsشاخص هایی هستند که برای نمایش تاثیر استخلاف ها به کار برده می¬شوند.علاوه بر این الکترون های انتقالی توسط پیوند سیگما وپای نیز برای همه مولکول های استخلاف شده مورد نظر محاسبه شده¬اند.نتایج بدست آمده برای این روش ها با یکدیگر متفاوت است.ب...

Journal: :Frontiers in electronic materials 2022

Dielectric capacitors are particularly suitable to store the electrical energy of a fast-changing nature. Here, we present review recent applications first principles and first-principles-based effective Hamiltonian approaches study storage in ferroelectrics, lead-free antiferroelectrics, relaxor nitride semiconductors. Specifically, these used investigate density efficiency perovskite BaTiO 3 ...

Journal: :Theoretical Chemistry Accounts 2005

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