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633f1b52b6dc8 AlytisGruodis

 

 

Dr. Alytis Gruodis

Phone: +370 610 04 723

E-mail: 

 

Institute / Center

Institute of Chemical Physics (ICP)

Research Area Molecular electronics, quantchemical simulations
Present position

Senior fellow 0.5

Scientific Interests, Keywords

Conformational studies, ground state/excited state geometry optimization, role of substituens for polar molecular compounds

Most important publications
  1. Guirgis, GA; Klaboe, P; Shen, SY; Powell, DL; Gruodis, A; Aleksa, V; Nielsen, CJ; Tao, J; Zheng, C; Durig, JR Spectra and structure of silicon-containing compounds. XXXVI - Raman and infrared spectra, conformational stability, ab initio calculations and vibrational assignment of ethyldibromosilane 2003 JOURNAL OF RAMAN SPECTROSCOPY 10.1002/jrs.989
  2. Tomkeviciene, A; Grazulevicius, JV; Kazlauskas, K; Gruodis, A; Jursenas, S; Ke, TH; Wu, CC Impact of Linking Topology on the Properties of Carbazole Trimers and Dimers 2011 JOURNAL OF PHYSICAL CHEMISTRY C 10.1021/jp111333v
  3. Magomedov, A; Paek, S; Gratia, P; Kasparavicius, E; Daskeviciene, M; Kamarauskas, E; Gruodis, A; Jankauskas, V; Kantminiene, K; Cho, KT; Rakstys, K; Malinauskas, T; Getautis, V; Nazeeruddin, MK Diphenylamine-Substituted Carbazole-Based Hole Transporting Materials for Perovskite Solar Cells: Influence of Isomeric Derivatives 2018 ADVANCED FUNCTIONAL MATERIALS 10.1002/adfm.201704351
  4. Johnson, MS; Billing, GD; Gruodis, A; Janssen, MHM Photolysis of nitrous oxide isotopomers studied by time-dependent hermite propagation 2001 JOURNAL OF PHYSICAL CHEMISTRY A 10.1021/jp011449x
  5. Gulbinas, V; Kodis, G; Jursenas, S; Valkunas, L; Gruodis, A; Mialocq, JC; Pommeret, S; Gustavsson, T Charge transfer induced excited state twisting of N,N-dimethylaminobenzylidene-1,3-indandione in solution 1999 JOURNAL OF PHYSICAL CHEMISTRY A 10.1021/jp9845468
  6. Krotkus, S; Kazlauskas, K; Miasojedovas, A; Gruodis, A; Tomkeviciene, A; Grazulevicius, JV; Jursenas, S Pyrenyl-Functionalized Fluorene and Carbazole Derivatives as Blue Light Emitters 2012 JOURNAL OF PHYSICAL CHEMISTRY C 10.1021/jp300161k
  7. Serevicius, T; Komskis, R; Adomenas, P; Adomeniene, O; Jankauskas, V; Gruodis, A; Kazlauskas, K; Jursenas, S Non-symmetric 9,10-diphenylanthracene-based deep-blue emitters with enhanced charge transport properties 2014 PHYSICAL CHEMISTRY CHEMICAL PHYSICS 10.1039/c4cp00236a
  8. Gudeika, D; Grazulevicius, JV; Volyniuk, D; Butkute, R; Juska, G; Miasojedovas, A; Gruodis, A; Jursenas, S Structure-properties relationship of the derivatives of carbazole and 1,8-naphthalimide: Effects of the substitution and the linking topology 2015 DYES AND PIGMENTS 10.1016/j.dyepig.2014.11.013
  9. Jursenas, S; Gruodis, A; Kodis, G; Chachisvilis, M; Gulbinas, V; Silinsh, EA Free and self-trapped charge-transfer excitons in crystals of dipolar molecules of N,N-dimethylaminobenzylidene 1,3-indandione 1998 JOURNAL OF PHYSICAL CHEMISTRY B 10.1021/jp971991e
  10. Sivalmurugan, V; Kazlauskas, K; Jursenas, S; Gruodis, A; Simokaitiene, J; Grazulevicius, JV; Valiyaveettil, S Synthesis and Photophysical Properties of Glass-Forming Bay-Substituted Perylenediimide Derivatives 2010 JOURNAL OF PHYSICAL CHEMISTRY B 10.1021/jp907697f
Other activities related to the development of the country's economy, culture and society

Editor-in-chief 2008..2018, scientific journal "Innovative Infotechnologies for Science, Business and Education" Editor-in-chief since 2022, Scientific journal "Applied Business: Issues and Solutions" scientific journal