نتایج جستجو برای: metal organic framework mof

تعداد نتایج: 833999  

Journal: :Chemphyschem : a European journal of chemical physics and physical chemistry 2012
Emmanuel Haldoupis Taku Watanabe Sankar Nair David S Sholl

Breathe in, breathe out: efficient methods are introduced for assessing the role of framework flexibility on molecular diffusion in metal-organic frameworks (MOFs) that does not require defining a classical forcefield for the MOF. These methods combine ab initio MD of the MOF with classical MD simulation of the diffusing molecules. The effects of flexibility are shown to be large for CH(4), but...

Journal: :Chemical communications 2016
Bendi Ramaraju Cheng-Hung Li Sengodu Prakash Chia-Chun Chen

A composite made from hollow polyhedron copper oxide and graphene oxide was synthesized by sintering a Cu-based metal-organic framework (Cu-MOF) embedded with exfoliated graphene oxide. As a proof-of-concept application, the obtained Cu(ox)-rGO materials were used in a lithium-ion battery and a sodium-ion battery as anode materials. Overall, the Cu(ox)-rGO composite delivers excellent electroch...

Journal: :Dalton transactions 2012
Qingxia Yao Junliang Sun Kuo Li Jie Su Maxim V Peskov Xiaodong Zou

A series of metal-organic frameworks representing a non-interpenetrated framework analogue of MOF-14 have been synthesized by using two different linkers, 4,4',4''-benzene-1,3,5-triyl-benzoic acid (H(3)BTB) and 4,4'-bipyridine (Bpy). Interestingly, the transition metal ions in the paddle-wheel metal clusters could be exchanged by other transition metal ions via a direct single-crystal to single...

Beygzadeh, Mojtaba , Golbabaei, Farideh , Khoshakhlagh, Amir Hossein , Shahtaheri, Seyed Jamaleddin ,

Introduction: Toluene is considered as a group of chemical contaminants, causing problems for people’s health. Due to the high rate of evaporation and rapid emission in the surrounding environment, it leads to the exposure of many employees and people at risk and, subsequently, its irreparable effects on their health in different jobs. Therefore, its removal is very important. In the present st...

Journal: :Dalton transactions 2016
G W Peterson M McEntee C R Harris A D Klevitch A W Fountain J R Soliz A Balboa A J Hauser

Electrical impedance spectroscopy, in conjunction with the metal-organic framework (MOF) UiO-66-NH2, is used to detect trace levels of the explosive simulant 2,6-dinitrotoluene. The combination of porosity and functionality of the MOF provides an effective dielectric structure, resulting in changes of impedance magnitude and phase angle. The promising data indicate that MOFs may be used in low-...

Journal: :Chemical science 2015
Shuai Yuan Tian-Fu Liu Dawei Feng Jian Tian Kecheng Wang Junsheng Qin Qiang Zhang Ying-Pin Chen Mathieu Bosch Lanfang Zou Simon J Teat Scott J Dalgarno Hong-Cai Zhou

We successfully assembled the photocatalytic titanium-oxo cluster and photosensitizing porphyrinic linker into a metal-organic framework (MOF), namely PCN-22. A preformed titanium-oxo carboxylate cluster is adopted as the starting material to judiciously control the MOF growth process to afford single crystals. This synthetic method is useful to obtain highly crystalline titanium MOFs, which ha...

2017
L Longley N Li F Wei T D Bennett

A nanoporous three-dimensional metal-organic framework (MOF), ZnPurBr undergoes a transition to a previously unreported high-temperature phase, ZnPurBr-ht. The transition, which proceeds without mass loss, is uncovered through the use of differential scanning calorimetry (DSC). The new crystal structure was solved using single-crystal X-ray diffraction, and the mechanical properties of both pha...

2015
Hui Wang Wei Zhu Jian Li Tian Tian Yue Lan Ning Gao Chen Wang Meng Zhang Charl F. J. Faul Guangtao Li

The controlled formation of MOF-based superstructures with well-defined nanoscale sizes and exquisite morphologies represents a big challenge, but can trigger a new set of properties distinct from their bulk counterparts. Here we report on the use of a self-assembled organic object to template the first example of a nanoscale metal–organic framework (MOF) with a helical morphology. Two prototyp...

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