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1. S. Racioppi. CHEMICAL BONDING IN METAL-ORGANIC SYSTEMS: NATURE, STRUCTURES AND PROPERTIES.

Degree: 2019, Università degli Studi di Milano

URL: http://hdl.handle.net/2434/606271 

The main purpose of my thesis is the application of theoretical and experimental methods for the study of the nature of the chemical bond and its effect on structures and properties in organome-tallic systems, like Metal Carbonyl Clusters and Coordination Polymers (CPs) featuring, in some of the cases under study, intrinsic porosity (in the following, PCP for Porous Coordination Polymers or MOFs for Metal-Organic Frameworks). Concerning metal clusters, we worked on high nuclearity metal carbonyl clusters, and, particularly, on those featuring semi-interstitial atoms. The chemical bonding and the related properties in these peculiar class of molecules are still a matter of discussion in the scientific community. Concerning the class of Metal-organic Frameworks, we focused our attention on azolate-based ligands as building blocks for the synthesis of MOFs, looking at their possible future application as ultra-low dielectric constant materials in electronic devices. Finally, we investigated the structural behavior of Coordination Polymers at non-ambient condition (high pressure, in the order of 0-8 GPa), to induce new interactions and attitudes like electric conductivity. This research required the application of a bunch of theoretical tools, assisted by accurate single crystal X-ray diffraction experiments in standard and not-standard conditions (low temperature and high pressure). Moreover, a protocol for comparing different energy decomposition methods was developed and successfully applied to investigate the bonding nature in simple and complex systems. Advisors/Committee Members: tutor: P. Mercandelli, MERCANDELLI, PIERLUIGI, SIRONI, ANGELO AGOSTINO DANIELE.

Subjects/Keywords: Chemical Bond; Energy Decomposition; Topology; Quantum Crystallography; Multipolar model; Settore CHIM/03 - Chimica Generale e Inorganica

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APA · Chicago · MLA · Vancouver · CSE | Export to Zotero / EndNote / Reference Manager

APA (6th Edition):

Racioppi, S. (2019). CHEMICAL BONDING IN METAL-ORGANIC SYSTEMS: NATURE, STRUCTURES AND PROPERTIES. (Thesis). Università degli Studi di Milano. Retrieved from http://hdl.handle.net/2434/606271

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Chicago Manual of Style (16th Edition):

Racioppi, S.. “CHEMICAL BONDING IN METAL-ORGANIC SYSTEMS: NATURE, STRUCTURES AND PROPERTIES.” 2019. Thesis, Università degli Studi di Milano. Accessed February 22, 2019. http://hdl.handle.net/2434/606271.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

MLA Handbook (7th Edition):

Racioppi, S.. “CHEMICAL BONDING IN METAL-ORGANIC SYSTEMS: NATURE, STRUCTURES AND PROPERTIES.” 2019. Web. 22 Feb 2019.

Vancouver:

Racioppi S. CHEMICAL BONDING IN METAL-ORGANIC SYSTEMS: NATURE, STRUCTURES AND PROPERTIES. [Internet] [Thesis]. Università degli Studi di Milano; 2019. [cited 2019 Feb 22]. Available from: http://hdl.handle.net/2434/606271.

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

Council of Science Editors:

Racioppi S. CHEMICAL BONDING IN METAL-ORGANIC SYSTEMS: NATURE, STRUCTURES AND PROPERTIES. [Thesis]. Università degli Studi di Milano; 2019. Available from: http://hdl.handle.net/2434/606271

Note: this citation may be lacking information needed for this citation format:
Not specified: Masters Thesis or Doctoral Dissertation

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