Surface reaction dynamics and energy partitioning
نویسندگان
چکیده
منابع مشابه
Reaction Dynamics of NH2+OH on an Interpolated Potential Energy Surface
QCT calculations were performed to study the behavior of energized NH2OH formed by association collision of NH2 radical with OH radical. A potential energy surface that describes the behavior of the title reaction has been constructed by interpolation of ab initio data. H2O, HON, HNO, NH3, O, H2NO, cis or trans-HONH, and H products and two vibrationally energized NH2OH and NH3O adducts were obs...
متن کاملthe study of bright and surface discrete cavity solitons dynamics in saturable nonlinear media
امروزه سالیتون ها بعنوان امواج جایگزیده ای که تحت شرایط خاص بدون تغییر شکل در محیط منتشر می-شوند، زمینه مطالعات گسترده ای در حوزه اپتیک غیرخطی هستند. در این راستا توجه به پدیده پراش گسسته، که بعنوان عامل پهن شدگی باریکه نوری در آرایه ای از موجبرهای جفت شده، ظاهر می گردد، ضروری است، زیرا سالیتون های گسسته از خنثی شدن پراش گسسته در این سیستم ها بوسیله عوامل غیرخطی بوجود می آیند. گسستگی سیستم عامل...
reaction dynamics of nh2+oh on an interpolated potential energy surface
qct calculations were performed to study the behavior of energized nh2oh formed by association collision of nh2 radical with oh radical. a potential energy surface that describes the behavior of the title reaction has been constructed by interpolation of ab initio data. h2o, hon, hno, nh3, o, h2no, cis or trans-honh, and h products and two vibrationally energized nh2oh and nh3o adducts were obs...
متن کاملSurface reaction dynamics.
The study of surface chemical reaction dynamics is crucial to many important areas of research such as heterogeneous catalysis, photocatalysis, material corrosion and etching, to name just a few. Many fundamental questions, for example mechanisms of important catalytic reactions, rely on the study of surface reaction dynamics. Prof. Gerhard Ertl’s achievements in this area exemplify the importa...
متن کاملSurface heterogeneity impacts on boundary layer dynamics via energy balance partitioning
The role of land-atmosphere interactions under heterogeneous surface conditions is investigated in order to identify mechanisms responsible for altering surface heat and moisture fluxes. Twelve coupled land surface – large eddy simulation scenarios with four different length scales of surface variability under three different horizontal wind speeds are used in the analysis. The base case uses L...
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ژورنال
عنوان ژورنال: Journal of Molecular Catalysis A: Chemical
سال: 2010
ISSN: 1381-1169
DOI: 10.1016/j.molcata.2009.06.012