CeNT
herb

Laboratorium Technologii Nowych Materiałów Funkcjonalnych

Zainteresowania naukowe zespołu skupiają się na chemii, a w szczególności na projektowaniu, syntezie i badaniach cech fizykochemicznych nowych związków chemicznych – w fazie stałej (‘extended’ tj. 1D, 2D, 3D) lub molekularnych (‘0D’).

Diagramy fazowe dla kombinacji pierwiastków metalicznych i niemetalicznych w różnych stosunkach stechiometrycznych, w zestawieniu z bardzo szerokimi zakresami ciśnień i temperatur dostępnych w dzisiejszych laboratoriach, oferują niewiarygodne bogactwo struktur i ważnych cech fizykochemicznych takich jak własności elektryczne, magnetyczne, termiczne, etc. W ramach CeNT chcielibyśmy kontynuować interdyscyplinarne badania eksperymentalne i teoretyczne na pograniczu chemii nowych materiałów, chemii fizycznej, fizyki ciała stałego i modelowania komputerowego metodami mechaniki kwantowej.

Wojciech Grochala, prof.
email: w.grochala@cent.uw.edu.pl
phone: 22 55 40828
room: 3084 (II siedziba)


“Chemically driven negative linear compressibility in sodium amidoborane, Na (NH2BH3).”
Magos-Palasyuk, Ewelina, Karol J. Fijalkowski, and Taras Palasyuk.
Scientific reports 6 (2016): 28745.
“Structural properties and the fluorite–pyrochlore phase transition in La 2 Zr 2 O 7: the role of oxygen to induce local disordered states.”
Paul, Barnita, Kushal Singh, Tomasz Jaroń, Anushree Roy, and Anirban Chowdhury.
Journal of Alloys and Compounds 686 (2016): 130-136.
Synthesis and characterization of a series of mixed-cation borohydrides of scandium: [Cat][Sc(BH4)4], [Cat]=[Me4N], [n-Bu4N], and [Ph4P]
Starobrat, A., Jaroń, T., & Grochala, W.
Inorganica Chimica Acta, 437, 70-73
“Towards a metallic quasi‐d9 system without copper: AgO at high pressure.”
Włodarska, Izabela, Mariana Derzsi, and Wojciech Grochala
physica status solidi (RRL)-Rapid Research Letters 9, no. 7 (2015): 401-404
“The first example of a mixed valence ternary compound of silver with random distribution of Ag (I) and Ag (II) cations.”
Mazej, Zoran, Tomasz Michałowski, Evgeny A. Goreshnik, Zvonko Jagličić, Iztok Arčon, Jadwiga Szydłowska, and Wojciech Grochala
Dalton Transactions 44, no. 24 (2015): 10957-10968
“Anomalous chemical shifts in X-ray photoelectron spectra of sulfur-containing compounds of silver (I) and (II).”
Grzelak, A., T. Jaroń, Z. Mazej, T. Michałowski, P. Szarek, and W. Grochala
Journal of Electron Spectroscopy and Related Phenomena 202 (2015): 38-45
“Facile Formation of Thermodynamically Unstable Novel Borohydride Materials by a Wet Chemistry Route.”
Jaroń, Tomasz, Wojciech Wegner, Karol J. Fijałkowski, Piotr J. Leszczyński, and Wojciech Grochala
Chemistry-A European Journal 21, no. 15 (2015): 5689-5692.
“Hydrogen Storage Materials: Room‐Temperature Wet‐Chemistry Approach toward Mixed‐Metal Borohydrides.”
Jaroń, Tomasz, Piotr A. Orłowski, Wojciech Wegner, Karol J. Fijałkowski, Piotr J. Leszczyński, and Wojciech Grochala.
Angewandte Chemie International Edition 54, no. 4 (2015): 1236-1239
“Noble Gas Monoxides Stabilized in a Dipolar Cavity: A Theoretical Study.”
Szarek, Paweł, and Wojciech Grochala
The Journal of Physical Chemistry A 119, no. 11 (2014): 2483-2489.
“Predicting crystal structures and properties of matter under extreme conditions via quantum mechanics: the pressure is on.”
Zurek, Eva, and Wojciech Grochala.
Physical Chemistry Chemical Physics 17, no. 5 (2015): 2917-2934.
“Unexpectedly Complex Crystalline Phases in the MSO3F–Ag (SO3F) 2 Phase Diagram (M= Na, K, Rb, Cs).”
Michałowski, T., Z. Mazej, A. Budzianowski, Z. Jagličić, P. J. Leszczyński, and W. Grochala.
European Journal of Inorganic Chemistry 2015, no. 2 (2015): 324-332.
“Ag [Fe (CO) 5] 2+: A Bare Silver Complex with Fe (CO) 5 as a Ligand.”
Malinowski, Przemysław J., and Ingo Krossing
Angewandte Chemie International Edition 53, no. 49 (2014): 13460-13462
“Polymorphism and hydrogen discharge from holmium borohydride, Ho (BH 4) 3, and KHo (BH 4) 4.” i
Wegner, Wojciech, Tomasz Jaroń, and Wojciech Grochala
international journal of hydrogen energy 39, no. 35 (2014): 20024-20030
“Most Probable Distance between the Nucleus and HOMO Electron: The Latent Meaning of Atomic Radius from the Product of Chemical Hardness and Polarizability.”
Szarek, Paweł, and Wojciech Grochala
The Journal of Physical Chemistry A 118, no. 44 (2014): 10281-10287
“M (BH 3 NH 2 BH 2 NH 2 BH 3)–the missing link in the mechanism of the thermal decomposition of light alkali metal amidoboranes.”
Fijalkowski, K. J., T. Jaroń, P. J. Leszczyński, E. Magos-Palasyuk, T. Palasyuk, M. K. Cyrański, and W. Grochala
Physical Chemistry Chemical Physics 16, no. 42 (2014): 23340-23346
“Next generation sequencing reveals microRNA isoforms in liver cirrhosis and hepatocellular carcinoma.”
Wojcicka, Anna, Michal Swierniak, Oskar Kornasiewicz, Wojciech Gierlikowski, Monika Maciag, Monika Kolanowska, Marta Kotlarek et al
The international journal of biochemistry & cell biology 53 (2014): 208-217
“Structures of late transition metal monoxides from Jahn-Teller instabilities in the rock salt lattice.”
Derzsi, Mariana, Przemysław Piekarz, and Wojciech Grochala
Physical review letters 113, no. 2 (2014): 025505
Diamond: the electronic ground state of carbon at temperatures approaching 0 k
Grochala, Wojciech
Angewandte Chemie International Edition, 53(14), 3680-3683
“MYb (BH4) 4 (M= K, Na) from laboratory X-ray powder data.”
Wegner, Wojciech, Tomasz Jaroń, and Wojciech Grochala
Acta Crystallographica Section C: Crystal Structure Communications 69, no. 11 (2013): 1289-1291
“Strong and long-lived free-radical oxidizer based on silver (II). Mechanism of Ag (I) electrooxidation in concentrated H2SO4.”
Połczyński, Piotr, Rafal Jurczakowski, and Wojciech Grochala
The Journal of Physical Chemistry C 117, no. 40 (2013): 20689-20696
“The Close Relationships between the Crystal Structures of MO and MSO4 (M= Group 10, 11, or 12 Metal), and the Predicted Structures of AuO and PtSO4.”
Derzsi, Mariana, Andreas Hermann, Roald Hoffmann, and Wojciech Grochala
European Journal of Inorganic Chemistry 2013, no. 29 (2013): 5094-5102
“Strong cationic oxidizers: thermal decomposition, electronic structure and magnetism of their compounds.”
Leszczyǹski, Piotr J., and Wojciech Grochala
Acta Chimica Slovenica 60, no. 3 (2013): 455-470
“M [Y (BH 4) 4] and M 2 Li [Y (BH 4) 6− x Cl x](M= Rb, Cs): new borohydride derivatives of yttrium and their hydrogen storage properties.”
Jaroń, Tomasz, Wojciech Wegner, and Wojciech Grochala
Dalton Transactions 42, no. 19 (2013): 6886-6893
“Na 2 AgF 4: 1D antiferromagnet with unusually short Ag 2+⋯ Ag 2+ separation.”
Kurzydłowski, Dominik, Zoran Mazej, and Wojciech Grochala
Dalton Transactions 42, no. 6 (2013): 2167-2173
“Redetermination of crystal structure of Ag (ii) SO 4 and its high-pressure behavior up to 30 GPa.”
Derzsi, Mariana, Armand Budzianowski, Viktor V. Struzhkin, Przemysław J. Malinowski, Piotr J. Leszczyński, Zoran Mazej, and Wojciech Grochala
CrystEngComm 15, no. 1 (2013): 192-198
“AgS 2 O 6 CF 3: the first trifluoromethylsulfonylsulfate (vi).”
Malinowski, Przemysław J., Mariana Derzsi, and Wojciech Grochala
Dalton Transactions 42, no. 29 (2013): 10417-1042
“Structural transition and unusually strong antiferromagnetic superexchange coupling in perovskite KAgF 3.”
Kurzydłowski, Dominik, Zoran Mazej, Zvonko Jagličić, Yaroslav Filinchuk, and Wojciech Grochala
Chemical Communications 49, no. 56 (2013): 6262-6264
“Stabilization and strong oxidizing properties of Ag (II) in a fluorine-free solvent.”
Połczyński, Piotr, Rafał Jurczakowski, and Wojciech Grochala
Chemical Communications 49, no. 68 (2013): 7480-7482
“Tetrabutylammonium cation in a homoleptic environment of borohydride ligands:[(n-Bu) 4 N][BH 4] and [(n-Bu) 4 N][Y (BH 4) 4].”
Jaroń, T., W. Wegner, M. K. Cyrański, and W. Grochala
Journal of Solid State Chemistry 191 (2012): 279-282
“Y (BD 4) 3, an efficient store of deuterium, and impact of isotope effects on its thermal decomposition.”
Jaroń, Tomasz, and Wojciech Grochala
Journal of Nuclear Materials 420, no. 1 (2012): 307-313
“Thermal and chemical decomposition of di (pyrazine) silver (II) peroxydisulfate and unusual crystal structure of a Ag (I) by-product.”
Leszczyński, Piotr J., Armand Budzianowski, Łukasz Dobrzycki, Michał K. Cyrański, Mariana Derzsi, and Wojciech Grochala
Dalton Transactions 41, no. 2 (2012): 396-402
“Crystal and electronic structure, lattice dynamics and thermal properties of Ag (i)(SO 3) R (R= F, CF 3) Lewis acids in the solid state.”
Grochala, Wojciech, Michał Ksawery Cyrański, Mariana Derzsi, Tomasz Michałowski, Przemysław J. Malinowski, Zoran Mazej, Dominik Kurzydłowski, Wiktor Koźmiński, Armand Budzianowski, and Piotr J. Leszczyński
Dalton Transactions 41, no. 7 (2012): 2034-2047
“Complete Series of Alkali-Metal M (BH3NH2BH2NH2BH3) Hydrogen-Storage Salts Accessed via Metathesis in Organic Solvents.”
Owarzany, Rafał, Karol J. Fijalkowski, Tomasz Jaroń, Piotr J. Leszczyński, Łukasz Dobrzycki, Michał K. Cyrański, and Wojciech Grochala
Inorganic chemistry 55, no. 1 (2015): 37-45
“Chemo-switched chromatic, magnetic and structural changes with retention of molecular crystallinity, Ni (12aneS 4)(BF 4) 2.”
Churchard, Andrew J., Mariana Derzsi, Zvonko Jagličić, Arndt Remhof, and Wojciech Grochala
Dalton Transactions 41, no. 17 (2012): 5172-5176
(n-Bu)4N+ cation in a homoleptic borohydride environment: (n-Bu)4N(BH4) and [(n-Bu)4N][Y(BH4)4]
Jaroń, T., Wegner, W., Cyrański, M.K., Dobrzycki, Ł., Grochala, W.
J Solid State Chem 2012, 191: 279–282
“The missing crystal structures of fluorosulfates of monovalent cations: M (I) SO 3 F, M= Na, Rb and Tl.”
Michałowski, Tomasz, Piotr J. Leszczyński, Michał Cyrański, Łukasz Dobrzycki, Armand Budzianowski, and Wojciech Grochala
Journal of Fluorine Chemistry 140 (2012): 116-1200
“Orbital Approach to the Electronic Structure of Solids”
Grochala, Wojciech
Angew Chem Int Ed Engl 2012, 51(33): 8155-8155
“A metastable He–O bond inside a ferroelectric molecular cavity:(HeO)(LiF) 2.”
Grochala, Wojciech
Physical Chemistry Chemical Physics 14, no. 43 (2012): 14860-14868
“Y (BD 4) 3, an efficient store of deuterium, and impact of isotope effects on its thermal decomposition.”
Jaroń, Tomasz, and Wojciech Grochala
Journal of Nuclear Materials 420, no. 1 (2012): 307-313
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