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Mukhaned L Keshtova, Serge. A. Kuklina, Ionv. O. Konstantinova, Alexei R. Khokhlovb, Zhiyuan Xiec, Chuandong Douc, Emmanuel N. Koukarasd, Rakesh Suthare, and Ganesh D. Sharmae

a Institute of Organoelement Compounds of the Russian Academy of Sciences, Vavilova St., 28, 119991 Moscow, Russian Federation
b Department of Physics of Polymers and Crystals, Faculty of Physics, M.V. Lomonosov Moscow State University, Leninskie Gory 1, 119991, Moscow, Russia
c Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022, China
d Laboratory of Quantum and Computational Chemistry, Department of Chemistry, Aristotle University of Thessaloniki, GR-54124 Thessaloniki, Greece
e Department of Physics, The LNM Institute for Information Technology, Jamdoli, Jaipur 302031, India

Lambros Seremetis, Emmanuel N. Koukaras, Sotiria Alexandri, Antonis Michail, George Kalosakas, John Parthenios, Costas Galiotis, Sotirios Tsirkas, Spyridon Grammatikopoulos, and Konstantinos Papagelis

Department of Physics, University of Patras, Patras 26504, Greece
Institute of Chemical Engineering Sciences, Foundation of Research and Technology-Hellas (FORTH/ICE-HT), Patras 26504, Greece
Laboratory of Quantum and Computational Chemistry, Department of Chemistry, Aristotle University of Thessaloniki, Thessaloniki GR-54124, Greece
Department of Materials Science, University of Patras, Patras 26504, Greece
Department of Chemical Engineering, University of Patras, Patras 26504, Greece
Department of Mechanical Engineering, School of Engineering, University of the Peloponnese, Patras 26334, Greece.

M.L. Keshtova, S.A. Kuklina, I.O. Konstantinova, I.E. Ostapova,b, Zh. Xiec, Emmanuel N. Koukarasd, Rakesh Suthare, Ganesh D. Sharmae

a Institute of Organoelement Compounds of the Russian Academy of Sciences, Vavilova St., 28, 119991 Moscow, Russia
b Department of Physics of Polymers and Crystals, Faculty of Physics, M.V. Lomonosov Moscow State University, Leninskie Gory 1, 119991 Moscow, Russia
c Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022, China
d Laboratory of Quantum and Computational Chemistry, Department of Chemistry, Aristotle University of Thessaloniki, GR-54124 Thessaloniki, Greece
e Department of Physics, The LNM Institute for Information Technology, Jamdoli, Jaipur 302017, India.

Mukhamed L. Keshtov1, Sergei A. Kuklin1, Chuandong Dou2, Emmanuel N. Koukaras3, Rahul Singhal4, Prateek Malhotra5, Ganesh D. Sharma5

1 Institute of Organoelement Compounds of the Russian Academy of Sciences, Moscow 119991, Russian Federation
2 Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022, China
3 Laboratory of Quantum and Computational Chemistry, Department of Chemistry, Aristotle University of Thessaloniki, Thessaloniki GR-54124, Greece
4 Department of Physics, Malviya National Institute of Technology, Jaipur, Rajasthan 302017, India
5 Department of Physics, The LNM Institute for Information Technology, Jaipur, Rajasthan 302017, India.

Charalampos Androulidakis1, Emmanuel N. Koukaras1,2, George Paterakis1,3, George Trakakis1, Costas Galiotis1,3

1 Institute of Chemical Engineering Sciences, Foundation of Research and Technology-Hellas (FORTH/ICE-HT), Stadiou Street, Platani, Patras 26504, Greece.
2 Laboratory of Quantum and Computational Chemistry, Department of Chemistry, Aristotle University of Thessaloniki, GR-54124 Thessaloniki, Greece.
3 Department of Chemical Engineering, University of Patras, Patras 26504, Greece.

Charalampos Androulidakisa, Emmanuel N. Koukarasa,b, Krishna Sampathkumarc,d, Jaroslava Rahovac,e, Costas Galiotisa,f, Otakar Frankc

a Institute of Chemical Engineering Sciences, Foundation of Research and Technology-Hellas (FORTH/ICE-HT), Stadiou Street, Platani, Patras, 26504, Greece
b Laboratory of Quantum and Computational Chemistry, Department of Chemistry, Aristotle University of Thessaloniki, GR-54124 Thessaloniki, Greece
c J.Heyrovsky Institute of Physical Chemistry of the CAS, v.v.i., Dolejskova 2155/3, 182 23 Prague 8, Czech Republic
d Central European Institute of Technology (CEITEC), Brno University of Technology, Purkynova 123, 612 00 Brno, Czech Republic
e Department of Inorganic Chemistry, Faculty of Science, Charles University in Prague, Albertov 6, 128 43 Prague 2, Czech Republic
f Department of Chemical Engineering, University of Patras, Patras 26504, Greece

Ioannis Skarmoutsosa,b, Emmanuel N. Koukarasb, and Emmanuel Klontzasa

a Theoretical and Physical Chemistry Institute, National Hellenic Research Foundation, Vass. Constantinou 48, GR-116 35, Athens, Greece
b Department of Chemistry, Laboratory of Quantum and Computational Chemistry, Aristotle University of Thessaloniki, 54124, Thessaloniki, Greece

Ioannis Skarmoutsosa,b, Emmanuel N. Koukarasb,c, Costas Galiotisb,d, George E. Froudakise, Emmanuel Klontzasa

a Theoretical and Physical Chemistry Institute, National Hellenic Research Foundation, Vass. Constantinou 48, GR-116 35, Athens, Greece
b Institute of Chemical Engineering Sciences, Foundation of Research and Technology-Hellas (FORTH/ICE-HT), Stadiou Street, Platani, Patras, 26504, Greece
c Department of Chemistry, Laboratory of Quantum and Computational Chemistry, Aristotle University of Thessaloniki, 54124, Thessaloniki, Greece
d Department of Chemical Engineering, University of Patras, GR-26504, Patras, Greece
e Department of Chemistry, University of Crete, Voutes, Heraklion, 71003, Crete, Greece

Alexandros G. Chronisa, Michael M. Sigalasa, Emmanuel N. Koukarasb,c

a Department of Materials Science, University of Patras, GR-26504, Patras, Greece
b Institute of Chemical Engineering Sciences, Foundation of Research and Technology-Hellas (FORTH/ICE-HT), Stadiou Street, Platani, Patras, 26504, Greece
c Molecular Engineering Laboratory, Department of Physics, University of Patras, 26500, GR Patras, Greece

Krishna Sampathkumara, b, Charalampos Androulidakisc, Emmanuel N. Koukarasc, Jaroslava Rahovaa, d, Karolina Drogowskaa, Martin Kalbaca, Aliaksei Vetushkae, Antonin Fejfare, Costas Galiotisc, f, Otakar Franka

a J.Heyrovsky Institute of Physical Chemistry of the CAS, v.v.i, Dolejskova 2155/3, 182 23, Prague 8, Czech Republic
b Central European Institute of Technology (CEITEC), Brno University of Technology, Purkynova 123, 612 00, Brno, Czech Republic
c Institute of Chemical Engineering Sciences, Foundation of Research and Technology-Hellas (FORTH/ICE-HT), Stadiou Street, Platani, Patras, 26504, Greece
d Department of Inorganic Chemistry, Faculty of Science, Charles University in Prague, Albertov 6, 128 43, Prague 2, Czech Republic
e Institute of Physics of the CAS, v.v.i, Cukrovarnicka 10/112, 162 00, Prague 6, Czech Republic
f Department of Chemical Engineering, University of Patras, Patras, 26504, Greece