[PDF] Top 20 Formation of diatomic molecules at surfaces
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Formation of diatomic molecules at surfaces
... The issues involved in the study of associative desorption are very closely related to those in the inverse process described above. In particular, the need for accurate potential energy surfaces is equally ... See full document
172
Bacterial Communities and their Influence on the Formation and Development of Potholes in Sandstone Surfaces of the Semi-Arid Colorado Plateau
... Each of these biofilms has an important role to play in pothole formation. Extracellular polymeric substance (EPS) produced by biofilms have both detrimental and beneficial effects on rock surfaces. They ... See full document
234
Functionalization of Si(111) Surfaces and the Formation of Mixed Monolayers for the Covalent Attachment of Molecular Catalysts in Photoelectrochemical Devices
... silicon surfaces (Figure 5.4). The experimental details for the formation of the 4-fluorostyrene- terminated silicon surface can be found in Appendix ... See full document
156
An investigation of microcrack formation on machined surfaces
... void formation at inclusions has been observed during rolling by Baker et al [115] who concluded that the strength of the inclusion-matrix interface is relatively ... See full document
345
Probing model interstellar grain surfaces with small molecules
... silicate surfaces that might be present in the interstellar ...simple diatomic adsorbates are found to wet the silica surface and exhibit first-order desorption kinetics in the regime up to monolayer ...the ... See full document
8
Functional Coatings Based on Denaturation and Adsorption of Proteins.
... 5.2.6. Formation of amphiphilic polymers on poly(ethylene terephthalate) (PET) surfaces In Chapter 3 of this thesis, we presented a simple method to endow PP fibers with amphiphilic coatings using protein ... See full document
210
The adsorption of amines and other small molecules on platinum surfaces
... first formation of polymeric species [71], The same system was investigated with UPS by Conrad et ...the formation of a surface polymer does not take place and that the P states of the mass 52 TDS are due ... See full document
139
Modelling of molecules on surfaces and thin-film photovoltaic absorbers
... defet omplexes 2V Cu + In C u [14℄. In future studies of this boundary the stability of the 2V Cu + In Cu omplex relative to the grain interior should be onsidered as well as the V Cu whih is the lowest energy defet in ... See full document
162
Construction and Analysis of Accurate Exchange-Correlation Potentials
... sociating molecules, weakly bound dimers, and transition-metal ...of formation of the step structure [24, 25] of the exact exchange-correlation potential in stretched heteronuclear diatomic ... See full document
164
Effect of Surface Treatment and Crystal Orientation on Microstructural Changes in Aluminized Ni Based Single Crystal Superalloy
... Figure 8 shows a schematic summary of the microstruc- tural changes after 100 heat cycles. The SRZ was observed in the grit-blasted (1110) surface and in its two neighboring sides, i.e. blasted (010) and mechanically ... See full document
5
Functionalisation of surfaces and interfaces : molecules, particles and crystals
... achieve. Formation of crystals from electrolyte solutions is a fundamental process in nature [118] as well as in industries such as building materials [119], in pharmaceutical industries for which crystallisation ... See full document
223
Properties of steel surfaces coated with organic molecules
... Before the thermal treatment any increase of the etching time has little or unimportant effect on the contact angle for the short 4 carbon as well as for the C12 chain. The C18 chain contact angle shows a 60 degree ... See full document
11
Study of the Double Nonlinear Quantum Resonances in Diatomic Molecules
... In this way, in this paper we study the quantum be- havior of this system in the region of parameters where this classical chaotic dynamics appears. This behavior could be important in the study of diatomic ... See full document
9
The formation of excimer molecules in microwave discharges
... THE FORMATION OF EXCIMER MOLECULES IN MICROWAVE DISCHARGES Timothy Graham Frank A Thesis Submitted for the Degree of PhD at the University of St Andrews.. 1984 Full metadata for this ite[r] ... See full document
270
A Universal Damping Function for Empirical Dispersion Correction on Density Functional Theory
... Designing a good damping function is critical in develop- ing a successful empirical dispersion corrected DFT method. We here propose a universal damping function that unifies different damping functions that have been ... See full document
7
An algebraic approach to molecular spectroscopy
... because diatomic molecules possess axial symmetry in the intrinsic frame, which simplifies the formalism and allows evaluation of the projection integrals in closed ... See full document
141
Polygonal tiling of some surfaces containing fullerene molecules
... Fullerenes are a family of carbon allotropes which composed entirely of carbon, in the form of a sphere, ellipsoid, cylinder, or tube. The structure of fullerenes is composed of hexagonal, pentagonal or sometimes ... See full document
7
Theoretical Investigation of Weak Interactions Between Diatomic Molecules with Distal Histidine On the Heme- Myoglobin in Gas and Solvent Medium
... often have an affective role in molecular structures and they are a significant factor in many chemical and biochemical processes. However, they are almost stronger than Van der Waals interactions and dipole forces, but ... See full document
12
Electron correlation in diatomic molecules
... As the differential equations resulting from various approximations to the solution of Schr8dingers equation are solved directly rather than by using a basis set expansion there is no co[r] ... See full document
99
Classical Chaos on Double Nonlinear Resonances in Diatomic Molecules
... in diatomic molecules is studied when chaos is driven by a circularly polarized resonant electric field and expanding up to fourth order of approximation the Morse’s potential and angular momentum of the ... See full document
14
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