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DFT calculations of electronic, structural, thermodynamic properties, magnetic moment, static and dynamic polarizability and hyperpolarizability of Ln(Tp)2 (Ln = rare earths, Tp = ring-unsubstituted tris(pyrazolyl)borate) complexes. Click to show full abstract
DFT calculations of electronic, structural, thermodynamic properties, magnetic moment, static and dynamic polarizability and hyperpolarizability of Ln(Tp)2 (Ln = rare earths, Tp = ring-unsubstituted tris(pyrazolyl)borate) complexes.
Keywords:
tris pyrazolyl;
pyrazolyl borate;
optical nonlinear;
nonlinear optical;
dft
Journal Title: New Journal of Chemistry
Year Published: 2019
Link to full text (if available)
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Journal Title: New Journal of Chemistry
Year Published: 2019
Link to full text (if available)
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recommendations!