Result with impact on practice detail
Quantum Mechanical Study of Lanthanide Complex Cp*2LnCl2(OEt2)2, where Ln = Sm, Nd
KROUTIL, O.; HERMANOVÁ, S.; RICHTERA, L.; ŽÍDEK, J.; JANČÁŘ, J.
Original Title
Quantum Mechanical Study of Lanthanide Complex Cp*2LnCl2(OEt2)2, where Ln = Sm, Nd
English Title
Quantum Mechanical Study of Lanthanide Complex Cp*2LnCl2(OEt2)2, where Ln = Sm, Nd
Type
Audiovisual work
Original Abstract
Paper deals Ab-initio caclulation using the DFT method on lanthanocene. Further the infrared and Raman spectra were used for simulations.
English abstract
Paper deals Ab-initio caclulation using the DFT method on lanthanocene. Further the infrared and Raman spectra were used for simulations.
Keywords
Ab-initio, DFT, lanthanocene, IR-spectrum, Raman-spectrum, simulations
Key words in English
Ab-initio, DFT, lanthanocene, IR-spectrum, Raman-spectrum, simulations
Authors
KROUTIL, O.; HERMANOVÁ, S.; RICHTERA, L.; ŽÍDEK, J.; JANČÁŘ, J.
Released
16.09.2008
Location
Brno, CZ
Pages from
1
Pages to
1
Pages count
1
BibTex
@misc{BUT63780,
author="Ondřej {Kroutil} and Soňa {Hermanová} and Lukáš {Richtera} and Jan {Žídek} and Josef {Jančář}",
title="Quantum Mechanical Study of Lanthanide Complex Cp*2LnCl2(OEt2)2, where Ln = Sm, Nd",
year="2008",
pages="1--1",
address="Brno, CZ",
note="Audiovisual work"
}