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EPR - ESR
This program calculates the powder pattern EPR spectra of a 2-spin electronic system.
Version 1.2.1 - published on 29 Nov 2010
doi:10254/nanohub-r6654.7 cite this
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| Category | Tools |
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| Abstract | This Program Calculates Powder Pattern EPR Spectra for a Dimeric System of Electronic Spins Si,j= 1/2 to 7/2 Using the Full Spin Hamiltonian. |
| Powered by | DDPOWJEA - v4.5 |
| Credits | Professor Joshua Telser, Roosevelt University - Chicago, IL 60605. |
| References | (1) Krzystek, J.; Ozarowski, A.; Telser, J. "Multi-frequency, high-field EPR as a powerful tool to accurately determine zero-field splitting in high-spin transition metal coordination complexes"; Coord. Chem. Revs. 2006, 250, 2308-2324. (2) Paramagnetic Resonance of Metallobiomolecules; ACS Symposium Series, vol. 858; J. Telser, Ed.; Washington, DC: American Chemical Society, 2003. (3) Desrochers, P. J.; Telser, J.; Zvyagin, S. A.; Ozarowski, A.; Krzystek, J.; Vicic, D. A. "Electronic Structure of Four-Coordinate C3v Nickel(II) Scorpionate Complexes: Investigation by High-Frequency and -Field Electron Paramagnetic Resonance and Electronic Absorption Spectroscopies"; Inorg. Chem. 2006, 45, 8930-8941. |
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