نتایج جستجو برای: organic crystals
تعداد نتایج: 254288 فیلتر نتایج به سال:
with the increasing population and the need for more food, as well as with the development of science and technology, human approach to unnatural and often chemical inputs to increase agricultural production has been a great expansion and problems such as increased cancers, chronic diseases has created environmental pollution. implementation of organic organic is a solution to these problems . ...
The electronic structure and linear and nonlinear optical susceptibilities of 2-methyl-4-nitroaniline (MNA) and 2-amino-4-nitroaniline (ANA) crystals have been studied using the full potential linear augmented plane wave method within density functional theory. In addition, we have investigated the excitonic effects by means of the bootstrap exchange-correlation kernel within time dependent den...
Metal-organic frameworks with high stability have been pursued for many years due to the sustainability requirement for practical applications. However, researchers have had great difficulty synthesizing chemically ultra-stable, highly porous metal-organic frameworks in the form of crystalline solids, especially as single crystals. Here we present a kinetically tuned dimensional augmentation sy...
With the impending surge of flexible organic electronic technologies, it has become essential to understand how mechanical deformation affects the electrical performance of organic thin-film devices. Organic single crystals are ideal for the systematic study of strain effects on electrical properties without being concerned about grain boundaries and other defects. Here we investigate how the d...
Single crystals of the metal-organic framework Ulm-4l(arge) (MFU-4l) can be grown site selectively on microtextured plasma polymer coatings comprising a pattern of alternating hydrophilic and hydrophobic domains. The crystals grow preferentially on the hydrophilic parts of the film surface. X-ray diffraction (XRD) shows that the cubic crystals have a high propensity to adhere with 〈1 0 0〉 orien...
Rubrene, perylene, -quaterthiophene, and tetracene single crystals were grown and placed between indiumtin-oxide and Al electrodes; the current-voltage characteristics of the so-fabricated two-terminal organic devices were measured at ambient conditions under solar simulator illumination. While rubrene single crystals do not exhibit any photovoltaic effect, open-circuit voltages reach values up...
Investigation of gypsum-based historical materials has two main problems: philological problems and technical issues. Technical issues, the main topic of this article, are normally consequences of physicochemical complexity of gypsum crystals in different conditions and variety of additives or mixed materials. Neglecting this technical problem, leads researchers to misunderstand or misinterpret...
We design and fabricate metallic photonic crystals that are integrated with highly-efficient third-order nonlinear polymers. Compared with nanoparticle-doped composite materials, metallic photonic crystals are favorable due to the presence of Bragg-grating-modulated surface plasmon polaritons (SPPs) with strong light localization in large spatial volumes to uniformly enhance the harmonic signal...
Despite remarkable progress in the field of MOFs, structures based on long-flexible organic linkers are scarce and the majority of such materials rely on rigid linkers. In this work, crystals of a new metal-organic double ladder (MODL) are obtained by linking a pentapeptide (NH2-Glu-pCO2Phe-pCO2Phe-Ala-Gly-OH) with cadmium acetate to produce a Cd(2-pyrrolidone-pCO2Phe-pCO2Phe-Ala-Gly)(H2O)3 fra...
We use first-principles computational methods to examine hole trapping in organic molecular crystals. We present a computational scheme based on the tuning of the fraction of exact exchange in hybrid density functional theory to eliminate the many-electron self-interaction error. With small organic molecules, we show that this scheme gives accurate descriptions of ionization and dimer dissociat...
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