Cina Foroutan-Nejad

Kierownik
Dr hab. Cina Foroutan-Nejad

Asystenci
Dr Mahdi Sasar

Doktoranci
M.Sc. Minu Sheeja

NCN OPUS 2020/39/B/ST4/02022
„Design of Functional Organic Memristors (DOOM)”

L. Tučková, A. Jaroš, C. Foroutan-Nejad, M. Straka, „A quest for ideal electric field-driven MX@C70 endohedral fullerene memristors: which MX fits the best?”, Phys. Chem. Chem. Phys.

G. Merino, M. Solà, I. Fernández, C. Foroutan-Nejad, P. Lazzeretti, G. Frenking, H. L. Anderson, D. Sundholm, F. P. Cossío, M. A. Petrukhina, J. Wu, J. I. Wu, A. Restrepo, „Aromaticity: Quo Vadis”, Chem. Sci.

B. J. R. Cuyacot, Z. Badri, A. Ghosh, C. Foroutan-Nejad, „Metallaaromaticity – a protean world”, Phys. Chem. Chem. Phys.

T. Li, E. M. Dief, Z. Kaluzňá, M. MacGregor, C. Foroutan-Nejad, N. Darwish, „On-Surface Azide–Alkyne Cycloaddition Reaction: Does It Click with Ruthenium Catalysts?”, Langmuir

C. S. Day, S. J. Ton, R. T. McGuire, C. Foroutan-Nejad, R. Martin, „Reductive Elimination from Sterically Encumbered Ni–Polypyridine Complexes”, Organometallics

C. S. Day, C. Dat Do, C. Odena, J. Benet-Buchholz, L. Xu, C. Foroutan-Nejad, K. H. Hopmann, R. Martin, „Room-Temperature-Stable Magnesium Electride via Ni(II) Reduction”, J. Am. Chem. Soc.

J. Poater, D.M. Andrada, M. Solà, C. Foroutan-Nejad, „Path-dependency of energy decomposition analysis & the elusive nature of bonding”, Phys. Chem. Chem. Phys.

S. Sowlati-Hashjin, V. Šadek, S. A. Sadjadi, M. Karttunen, A. Martín-Pendás, C. Foroutan-Nejad, „Collective interactions among organometallics areexotic bonds hidden on lab shelves”, Nat. Commun.

B. J. R. Cuyacot, C. Foroutan-Nejad, „[{Th(C8H8)Cl2}3]2− is stable but not aromatic”, Nature

B. J. R. Cuyacot, I. Durník, C. Foroutan-Nejad, R. Marek, „Anatomy of Base Pairing in DNA by Interacting Quantum Atoms”, J. Chem. Inf. Model.

C. Foroutan-Nejad, „A double bond with weak σ- and strong π-interactions is still a double bond”, Nat. Commun.

C. Foroutan-Nejad, „Bonding and Aromaticity in Electron-Rich Boron and Aluminum Clusters”, J. Phys. Chem. A

A. Jaroš, C. Foroutan-Nejad, M. Straka, „From π Bonds without σ Bonds to the Longest Metal–Metal Bond Ever: A Survey on Actinide–Actinide Bonding in Fullerenes”, Inorg. Chem.

D. M. Andrada, C. Foroutan-Nejad, „Energy components in energy decomposition analysis (EDA) are path functions; why does it matter?”, Phys. Chem. Chem. Phys.

C. Foroutan‐Nejad, „The Na⋅⋅⋅B Bond in NaBH3−: A Different Type of Bond”, Angew. Chem. Int. Ed.

C. Foroutan-Nejad, J. Vícha, A. Ghosh, „Relativity or aromaticity? A first-principles perspective of chemical shifts in osmabenzene and osmapentalene derivatives”, Phys. Chem. Chem. Phys.

A. Jaroš, E. F. Bonab, M. Straka, C. Foroutan-Nejad, „Fullerene-Based Switching Molecular Diodes Controlled by Oriented External Electric Fields”, J. Am. Chem. Soc.

J. Vícha, C. Foroutan-Nejad, M. Straka, „1H NMR is not a proof of hydrogen bonds in transition metal complexes”, Nat. Commun.

C. Foroutan‐Nejad, M. Straka, I. Fernández, G. Frenking, „Buckyball Difluoride F2−@C60+—A Single-Molecule Crystal”, Angew. Chem. Int. Ed.

M. Novák, C. Foroutan-Nejad, R. Marek, „Modulating Electron Sharing in Ion-π-Receptors via Substitution and External Electric Field: A Route toward Bond Strengthening”, J. Chem. Theory Comput.

Z. Badri, C. Foroutan-Nejad, „Unification of ground-state aromaticity criteria – structure, electron delocalization, and energy – in light of the quantum chemical topology”, Phys. Chem. Chem. Phys.

C. Foroutan-Nejad, Z. Badri, R. Marek, „Multi-center covalency: revisiting the nature of anion–π interactions”, Phys. Chem. Chem. Phys.

J. Vícha, C. Foroutan-Nejad, T. Pawlak, M. L. Munzarová, M. Straka, R. Marek, „Understanding the Electronic Factors Responsible for Ligand Spin–Orbit NMR Shielding in Transition-Metal Complexes”, J. Chem. Theory Comput.

C. Foroutan-Nejad, „Is NICS a reliable aromaticity index for transition metal clusters?” Theor. Chem. Acc.

C. Foroutan-Nejad, S. Shahbazian, R. Marek, „Toward a Consistent Interpretation of the QTAIM: Tortuous Link between Chemical Bonds, Interactions, and Bond/Line Paths”, Chem. – Eur. J.

C. Foroutan-Nejad, R. Marek, „Potential energy surface and binding energy in the presence of an external electric field: modulation of anion–π interactions for graphene-based receptors”, Phys. Chem. Chem. Phys.