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#polarizability

Every note tagged #polarizability, newest first — or browse the full archive.

February 28, 2025 Chemistry

Polarizability Trends in Carbon-Chalcogen Diatomic Molecules - A Computational Study

A systematic computational investigation of polarizability in diatomic molecules formed between carbon and Group 16 (O, S, Se, Te) elements, with analysis of geometry-optimized structures and higher-order electronic properties.

#quantum chemistry#polarizability#computational chemistry#psi4#carbon#chalcogens
February 27, 2025 Chemistry

Polarizability Trends in Group 14-16 Heteronuclear Molecules - A Computational Study

A systematic computational investigation of polarizability trends in diatomic molecules formed between Group 14 (C, Si, Ge, Sn, Pb) and Group 16 (O, S, Se, Te) elements, showcasing the power of automation and open-source computational chemistry tools.

#quantum chemistry#polarizability#computational chemistry#psi4#heteronuclear molecules
pj Peter V. Johnston

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