NIMP| Neatu Florentina, Author at NIMP

Expertize

Preparation of heterogeneous catalysts using wet impregnation, incipient wetness, ionic exchange and physical mixture methods. Experience in organic synthesis and several catalytic reactions (fine organic chemistry, green chemistry, and asymmetric chemistry). Running catalytic batch and fixed bed flow reactors in various conditions (high pressure and temperature). Characterization of catalysts using PXRD, textural measurements, FTIR, DRIFT, DR-UV-Vis, Raman, XPS, TG-DTA, elemental analysis CHNS/O, TEM, SEM/EDX, solid state RMN and compounds analysis (GC, GC-MS, HPLC/UPLC, TLC, RMN).

Selected publications

F. Iosif, S. Coman, V.I. Parvulescu, P. Grange, S. Delsarte, D. De Vos, P. Jacobs, Chem. Commun., (11), 2004, 1292-1293, DOI:10.1039/B403692A. “Ir-Beta zeolite as a heterogeneous catalyst for the one-pot transformation of citronellal to menthol”

F. Iosif, V.I. Parvulescu, M. E. Pérez-Berna, R. J. Ruano-Casero, V. Rives, K. Kranjc, S. Polanc, M. Kocevar, E. Genin, J.-P. Genêt, V. Michelet, J. Mol. Catal A: Chemical., 276(1-2),2007,34-40, DOI: 10.1016/j.molcata.2007.06.018. Heterogeneous hydrogenation of bicyclo[2.2.2]octenes on Rh/TPPTS/LDH catalysts”

F. Neatu, A. Kraynov, L. D’Souza, V.I. Parvulescu, K. Kranjc, M. Kocevar, V. Kuncser, R. Richards, Appl. Catal. A.: Gen.,346(1-2),2008, 28-35, DOI: 10.1016/j.apcata.2008.04.024. “Iron Oxide Colloids and their Heterogenization by Silica Sol-gel Entrapment: Catalytic and Magnetic Properties”

Florentina Neatu, Zhi Li, Ryan Richards, Patrick Y. Toullec, Jean-Pierre Genêt, Karifala Dumbuya, J. Michael Gottfried, Hans-Peter Steinrück, Vasile I. Parvulescu, Véronique Michelet,Chem. Eur. J., 14(30), 2008, 9412-9418, DOI: 10.1002/chem.200801327. „Heterogeneous Gold Catalysts for Efficient Access to FunctionalizedLactones”

Florentina Neatu, Vasile I. Parvulescu, Véronique Michelet, Jean-Pierre Gênet, Alexandre Goguet, Christopher Hardacre, New J. Chem., 33(1),2009, 102-106, DOI: 10.1002/chin.200922102. “Gold imidazolium-basedionic liquids, efficient catalysts for cycloisomerization of -acetylenic carboxylic acids”

Florentina Neatu, Patrick Toullec, Véronique Michelet, Vasile I. Parvulescu, Pure Appl. Chem., 81(12),2009, 2387-2396, DOI: 10.1002/chin.201023232. „Heterogeneous Au and Rh catalysts for cycloisomerization reactions of -acetylenic carboxylic acids”

Florentina Neatu,Loredana Protesescu,Mihaela Florea,Vasile I. Parvulescu, Cristian M. Teodorescu,Nicoleta Apostol,Patrick Y. Toullec,Veronique Michelet,Green Chem., 12(12), 2010, 2145–2149, DOI: 10.1039/C0GC00258E. “Novel Pd heterogeneous catalysts for cycloisomerisation of acetylenic carboxylic acids”

Primo, F. Neatu, M. Florea, V.I. Parvulescu, H. Garcia, Nature Communications, 5, 2014, 5291, DOI: 10,1038/ncomms6291 “Graphenes in the absence of metals as carbocatalysts for selective acetylene hydrogenation and alkene hydrogenation”

M. Florea, R.S. Marin, F.M. Palasanu, F. Neatu, V.I. Parvulescu, Catalysis Today, 254, 2015, 29–35, DOI: 10.1016/j.cattod.2014.12.026, “Mesostructured vanadia-alumina catalysts for the synthesis of vitamin K3”

A. Moragues, F. Neatu, V.I. Parvulescu, M.D. Marcos, P. Amoros, V. Michelet, ACS Catalysis, 5(9), 2015, 5060–5067, DOI: 10.1021/acscatal.5b01207 “Heterogeneous Gold Catalyst: Synthesis, Characterization and Application in 1,4-Addition of Boronic Acids to Enones”

F. Neatu, M. Ciobanu, L.E. Stoflea, L. Frunza, V.I. Parvulescu, V. Michelet, Catalysis Today, 247, 2015, 155–162, DOI: 10.1016/j.cattod.2014.07.004 “Arylation of alkynes over hydrotalcite docked Rh-m-TPPTC complex”

F. Neatu, R.S. Marin, M. Florea, N. Petrea, O.D. Pavel, V.I. Parvulescu, Applied Catalysis B: Environmental, 180, 2016, 751–757, DOI: 10.1016/j.apcatb.2015.07.043 “Selective oxidation of 5-hydroxymethyl furfural over non-precious metal heterogeneous catalysts”

Neatu F., Petrea N., Petre R., Somoghi V., Florea M., Parvulescu V.I. Catalysis Today 278 (2016) 66–73 DOI: 10.1016/j.cattod.2016.03.031 „Oxidation of 5-hydroxymethyl furfural to 2,5-diformylfuran in aqueous media over heterogeneous manganese based catalysts”

M.-M. Trandafir, M. Florea, F. Neaţu, Dr. A. Primo, V. I. Parvulescu, Hermenegildo García, ChemSusChem, 9 (13) 2016, 1565-1569; DOI: 10.1002/cssc.201600197, „Graphene from Alginate Pyrolysis as a Metal-Free Catalyst for Hydrogenation of Nitro Compounds”

F. Neaţu, G. Culică, M. Florea, V. I. Parvulescu, F. Cavani, ChemSusChem, 9 (21), 2016, 3102–3112 „Synthesis of terephthalic acid by means of p-cymene oxidation with O2: toward a more sustainable production of bio-PET”

M. M. Trandafir, L. Pop, N. D. Hădade, M. Florea,a F. Neațu, C. M. Teodorescu, B. Duraki, J. A. van Bokhoven, I. Grosu, V. I. Pârvulescu, H. Garcia, Catal. Sci. Technol., 6, 2016, 8344-8354 „An adamantane-based covalent–organic framework: stability, adsorption capability, and behaviour as catalyst and support for Pd and Au for the hydrogenation of nitrostyrene”

F. Neațu, M. M. Trandafir, M. Marcu, L. Preda , J. Maria Calderon-Moreno, Ș. Neațu, S. Somacescu, M. Florea, , Catalysis Comm., 93, 2017, 37-42. „Ni and Co doped zirconia potential electrocatalyst for oxygen reduction reaction (ORR)”

M. Florea, F. Matei-Rutkovska, G. Postole, A. Urda, F. Neatu, V.I. Pârvulescu, P. Gelin: Catalysis Today 306, 2018, 166-171, "Doped ceria prepared by precipitation route for solid oxide fuel cells operated on methane".

M. Florea, F. Matei-Rutkovska, G. Postole, A. Urda, F. Neatu, L. Massin, P. Gelin: Catalysis Science & Technology 8(5), 2018, 1333-1348 "Influence of Gd and Pr doping on the properties of ceria: texture, structure, redox behaviour and reactivity in CH4/H2O reactions in the presence of H2S"

S. Somacescu, N. Cioatera, P. Osiceanu, J. M. Calderon-Moreno, C. Ghica, F. Neatu, M. Florea: Applied Catalysis B: Environmental 241, 2019, 393-406 "Bimodal mesoporous NiO/CeO2-δ–YSZ with enhanced carbon tolerance in catalytic partial oxidation of methane - potential IT-SOFCs anode"

Research projects

Researcher project manager:

· Programul Național III – Contract TE 64/2018 - „Tunable acid-base mesoporous hollow spheres advanced materials for rubber intermadiates” – Finanțat de Ministerul Cercetării și Educației prin Programul 1 – Dezvoltarea sistemului national de cercetare-dezvoltare, Subprogramul 1.1 Resurse umane.

· Programul Național PNCDI – Contract 98PED/2017 - „A general methodology for bio-polymers precursors synthesis: Mono- and di- aromatic carboxylic acids by catalytic routes” – Finanțat de Ministerul Cercetării și Educației prin programul Proiecte experimental-demonstrative.

· Programul Național PNCDI – Contract PD 29/2013 - „Heterogeneous nanocatalysts with application in tandem Sonogashira/lactonisation reaction” – Finanțat de Ministerul Cercetării și Educației prin programul Resurse Umane.

· Programul Național PNCDI – Contract PCCA 166/2012 - „Biomaterials synthesis for polyesters industry with applicability in the production of ballistic protection equipments” – Finanțat de Ministerul Cercetării și Educației prin programul Parteneriate.

· Programul Național PNCDI – Contract CNCSIS 96/GR/2007, CNCSIS Cod 358 – „Unsaturated ketones arylation catalysed by Rh-TPPTS and Rh-TPPTC immobilized on hydrotalcites” – Finanțat de Ministerul Cercetării și Educației prin programul CNCSIS TD.

· Programul Național PNCDI – Contract CNCSIS GR/135/2006, CNCSIS Cod 358 – „Immobilized Rh clusters for amino acids synthesis” – Finanțat de Ministerul Cercetării și Educației prin programul CNCSIS TD.

· Programul Național PNCDI – Contract CNCSIS nr. 34669/2005, 12^ththeme TD, CNCSIS Cod 358 – „Immobilized Rh clusters for amino acids synthesis” – Finanțat de Ministerul Cercetării și Educației prin programul CNCSIS TD.

· National Program PNCDI – Contract CNCSIS nr. 33379/2004, 11^ththeme TD, CNCSIS Cod 358 – „Immobilized Rh clusters for amino acids synthesis” – Finanțat de Ministerul Cercetării și Educației prin programul CNCSIS TD.

Projects

1. O metodologie generala de sinteza (a precursorilor de bio-polimeri: cai catalitice de obtinere a acizilor aromatici mono- si dicarboxilici – BIOPREC)

Project Type: PED, Start Date: 2017-01-03 End Date: 2018-07-02

2. MATERIALE AVANSATE: SFERE MEZOPOROASE CU PROPRIETATI ACIDO-BAZICE CONTROLABILE PENTRU INTERMEDIARI DE CAUCIUC

Project Type: TE, Start Date: 2018-05-02 End Date: 2020-04-30

3. Tunable acid-base mesoporous hollow spheres advanced materials for rubber intermediates

Project Type: TE, Start Date: 2018-05-02 End Date: 2020-04-30

Recent Publications

1. Structural distortion dependence of thermoelectric properties in CoFeZrSi Heusler material

Authors: Birsan, A

Published: APR 25 2020, DOI: 10.1016/j.jallcom.2019.153492

Abstract: The effect of potential tetragonal and triclinic distortions of the energetic favorable cubic crystalline structure in CoFeZrSi Heusler compound, was investigated, using semiclassic Boltzmann theory on the thermoelectric functionalities. Chemical potential dependence of the conductivity integral sigma/tau for relaxed cubic and tetragonal structures confirms p-type thermoelectric characteristics. When triclinic deformation is investigated, the electrical conductivity response indicates that the material's ability to conduct electric current decreases. The calculated Seebeck coefficients exhibit positive values for the crystalline structures whose angles are equal to 90 degrees (cubic and tetragonal), over the 300-1200K temperature range. The figures of merit ZT, for relaxed cubic and tetragonal structures, at optimum unit cell volume or higher, present around room temperature, promising features as a potential thermoelectric material (i.e. ZT = 0.94 for 350K in optimum cubic structure). (C) 2019 Elsevier B.V. All rights reserved.

2. Crystal and magnetic structures, magnetic and ferroelectric properties of strontium ferrite partially substituted with in ions

Authors: Turchenko, V; Kostishyn, VG; Trukhanov, S; Damay, F; Porcher, F; Balasoiu, M; Lupu, N; Bozzo, B; Fina, I; Trukhanov, A; Waliszewski, J; Recko, K; Polosan, S

Published: APR 25 2020, DOI: 10.1016/j.jallcom.2019.153412

Abstract: The influence of temperature factor to crystal structure as well as magnetic and electric properties of strontium hexaferrite partially substituted with diamagnetic indium ions has been investigated. Ferroelectric properties have been found out in SrFe11.9In0.1O19 compound that contradicts to conventional opinion, which describe its crystal structure within the framework of centrosymmetric space group P6(3)/mmc (No. 194). For determination features of the crystal structure, which are responsible for ferroelectric properties of strontium hexaferrite, have been carried out neutron diffraction measurements with high resolution in temperature range from 1.5 to 740 K. The analysis of hexaferrite structure has been executed within the framework both centrosymmetric and non-centrosymmetric space group. Values of coefficients of magneto crystalline anisotropy at 5 and 300 K and influence of ambient temperature to linear size of magnetic regions have been determined from magnetic measurements. (C) 2019 Elsevier B.V. All rights reserved.

3. Radiation damage in p-type EPI silicon pad diodes irradiated with protons and neutrons

Authors: Gurimskaya, Y; de Almeida, PD; Garcia, MF; Suau, IM; Moll, M; Fretwurst, E; Makarenko, L; Pintilie, I

Published: APR 1 2020, DOI: 10.1016/j.nima.2019.05.062

Abstract: In view of the HL-LHC upgrade, radiation-tolerant silicon sensors containing low-resistivity p-type implants or substrates, like LGAD or HV-CMOS devices, are being developed in the framework of ATLAS, CMS, RD50 and other sensor R&D projects. These devices are facing a particular problem - the apparent deactivation of the doping due to the irradiation, the so-called acceptor removal effect. In the present work proton and neutron fluence-dependent radiation damage effects, including the change in leakage current and effective doping concentration, space charge sign-inversion, but also introduction and annealing of point- and cluster-like defects have been studied in Si pad diodes fabricated from p-type EPI material of different resistivity (10-1000 Omega cm). Standard electrical characterisations (IV, CV), TCT (Transient Current Technique) and TSC (Thermally Stimulated Current) techniques were applied. A correlation between effective doping concentration obtained from CV measurements and defect concentration N-t extracted from TSC measurements for both - neutron and proton - irradiations was observed pointing towards the microscopic origin of the acceptor removal. A detailed analysis of the dominant TSC peaks - E(30), BiOi and three main deep acceptor levels H(116), H(140) and H(152) - responsible for the changes in the effective space charge is performed. The origin and annealing behaviour of E(30) and H(40) and other cluster-related defects are discussed as well.

4. Low temperature CO sensing under infield conditions with in doped Pd/SnO2

Authors: Stanoiu, A; Ghica, C; Somacescu, S; Kuncser, AC; Vlaicu, AM; Mercioniu, IF; Florea, OG; Simion, CE

Published: APR 1 2020, DOI: 10.1016/j.snb.2020.127717

Abstract: A one-step method assisted by hydrothermal treatment was approached to obtain nanocrystalline 1 and 10 mol. % In doped 2 mol.% Pd-SnO2 powders using a non-ionic surfactant Brij52 and Polyethylene glycol 6000 (PEG) as templates. Depending on In content, the samples were labeled as Pd1InSn and Pd10InSn. The obtained materials consist of nanosized crystallites packed into micrometric grains with a high porosity, as revealed by the morphological and structural investigations (SEM, TEM). A dependence of the grain size with respect to the In content has been revealed i.e. the sample Pd1InSn was showing an average grain size of around 10 nm, whilst for the sample Pd10InSn the average grain size was found to be around 5 nm. The XPS investigations highlighted the differences occurred in the surface chemistry in terms of surface hydroxylation as well as the chemical states of Pd. The sensing properties towards different CO concentrations have been examined under infield background conditions, at low operating temperature of 50 degrees C. The sensing mechanism model for CO was discussed in detail according to the possible interplay between oxygen and water related species based on the experimentally results acquired through simultaneous electrical resistance and work function measurements.

5. Investigation of Ba0.6Sr0.4TiO3 thick films by means of a novel THz-TDS approach

Authors: Nedelcu, L; Annino, G; Chirila, C; Trupina, L; Galca, AC; Banciu, MG

Published: MAR 15 2020, DOI: 10.1016/j.apsusc.2019.144807

Abstract: Ba0.6Sr0.4TiO3 (BST) ferroelectric thick films were grown on MgO(001) and Al2O3 (0 0 0 1) single-crystal substrates by using a pulsed laser deposition method. Structural, morphological, optical, and terahertz characterization of the BST films were performed by X-ray Diffraction, Atomic Force Microscopy, Spectroscopic Ellipsometry (SE), and Terahertz Time-Domain Spectroscopy (THz-TDS). Single-phase samples with strong preferred (1 1 1) orientation and surface roughness lower than 1.5% of their thicknesses have been obtained for both types of substrates. SE was employed to extract the thickness and optical properties by using a 3-layer optical model (substrate/thin film/roughness). The inferred refractive index @630 nm is around 2.05, while the optical interference is visible until 3.3 eV. The THz-TDS measurements in transmission set-up were carried out one after the other on substrates before and after the BST film deposition. The standard THz-TDS analysis of double-layer samples proved difficult to complete in the cases in which a thin or thick film is deposited on a much thicker substrate of known dielectric properties. However, we have been able to extract the complex dielectric permittivity in the THz domain for BST samples with thicknesses of few microns, by developing a specific procedure of data analysis.

6. Unexpected magneto-functionalities of amorphous Fe-Gd thin films crossing the magnetization compensation point

Authors: Stanciu, AE; Schinteie, G; Kuncser, A; Iacob, N; Trupina, L; Ionita, I; Crisan, O; Kuncser, V

Published: MAR 15 2020, DOI: 10.1016/j.jmmm.2019.166173

Abstract: A complex investigation of the morpho-structural, magnetic, magneto-optical and magneto-transport properties of amorphous Fe-Gd thin films crossing the magnetization compensation point is reported and the unexpected observed magneto-functionalities are discussed. A tendency of magnetic domain formation with increasing the Fe content over the compensation concentration is observed. The switch from a reversed Magneto-optical Kerr Effect loop to a direct loop when increasing the Fe content over the compensation point is explained via the specific contribution to the rotation of the polarization vector from each magnetic sublattice, belonging to Fe and Gd, respectively. Local atomic configurations and magnetic interactions ascertained the amorphous character and revealed an out-ofplane orientation of the magnetic moment of Fe above the compensation point. The thermomagnetic curves prove a concentration dependent behavior, explained by weakly coupled magnetization relaxation processes of the two magnetic sub-lattices. On the other hand, the magnetic hysteresis loops gave evidence of two exchange coupled magnetic phases with different coercive fields. According to structural and Fe-57 Mossbauer Spectroscopy results, the two phases correspond to definite nanosized volumes of two different average concentrations (one of them closer to the compensation point) which are randomly distributed in the film. The unexpected single step-like behavior of the magneto-resistivity curves was explained by dissimilar switching of the spins in these two magnetic phases distributed in nano-sized volumes.

7. (Ba,Sr)TiO3 solid solutions sintered from sol-gel derived powders: An insight into the composition and temperature dependent dielectric behavior

Authors: Patru, RE; Ganea, CP; Stanciu, CA; Surdu, VA; Trusca, R; Ianculescu, AC; Pintilie, I; Pintilie, L

Published: MAR 2020, DOI: 10.1016/j.ceramint.2019.10.136

Abstract: Single-phase Ba1-xSrxTiO3 (BST) perovskite ceramics with 0.3 <= x <= 0.4 were prepared from powders synthesized via sol-gel route. The compositions have the ferroelectric-paraelectric phase transition close to room temperature. At 20 degrees C the BST ceramics are ferroelectric for 0.3 <= x <= 0.35 and paraelectric for x = 0.375 and x = 0.40. The study follows the relation between the structural changes produced when increasing the Sr content and the dielectric properties at low intensity electric fields. It is found that the grain size and tetragonality decreases as the Sr content increases. Analyses of complex permittivity and impedance spectroscopy reveal the temperature and frequency dependencies of the dielectric properties. The phase transitions seem to be of first order for all compositions, with a thermal hysteresis that decreases with increasing the Sr content, fact attributed to the corresponding increase of the grain boundaries weight allowing a more efficient stress relaxation in the structure during the change of the symmetry from cubic to tetragonal. The diffusiveness degree during the phase transition is increasing with Sr content, suggesting some relaxor-type contribution attributed to smaller grain size. The ac conductivity follows the universal Jonscher law, with an ac component having the power parameter s independent of Sr content, and a dc component that it is thermally activated with an activation energy of about 0.7-0.77 eV attributed to oxygen vacancies acting as donor-like defects. The fit of impedance spectra at different temperatures and frequencies is obtained by using an equivalent circuit accounting the grains, grain boundaries, electrode interfaces and the local contributions produced by reorientation of defect dipoles or defect clusters. All the component circuits have significant variations around phase transitions. These are discussed in relation to structural changes occurring during transition and considering the changes in the distribution of various charges when polarization vanishes.

8. PVDF-ferrite composites with dual magneto-piezoelectric response for flexible electronics applications: synthesis and functional properties

Authors: Gheorghiu, F; Stanculescu, R; Curecheriu, L; Brunengo, E; Stagnaro, P; Tiron, V; Postolache, P; Buscaglia, MT; Mitoseriu, L

Published: MAR 2020, DOI: 10.1007/s10853-019-04279-w

Abstract: In the present work, a magnetodielectric flexible thick film composite with a quaternary Ba12Fe28Ti15O84 ferrite filler (<= 9 vol%) embedded into PVDF polymer matrix was investigated. The role of filler volume on the macroscopic dielectric, magnetic and ferroelectric properties as well as on the nanoscale magnetic and piezoelectric response was analyzed. The formation of small amounts of polar phases besides the majority alpha-phase of PVDF was shown by XRD and FTIR combined analysis. The electrical properties are dominated by the polymer response, while magnetic order is derived as sum property from the ferrite ones, having a predominant soft magnetic character with small coercivity of H-c similar to 60 Oe and high saturation magnetization of M-s = 2.6 emu/g for the highest concentration of 9 vol%. Permittivity and losses slightly increase with ferrite filler addition, and the composite maintains a dielectric character for all the compositions. Local PFM and MFM investigations have shown a combined ferro/piezoelectric character and magnetic order, with magnetoelectric coupling demonstrated by the reorientation of filler particles and modifications of local piezoresponse when applying a static magnetic field.

9. Quantum dot exciton dephasing by Coulomb interaction: A fermionic analog of the independent boson model

Authors: Dinu, IV; Tolea, M; Gartner, P

Published: FEB 18 2020, DOI: 10.1103/PhysRevB.101.085304

Abstract: The time evolution of a quantum dot exciton in Coulomb interaction with wetting layer carriers is treated using an approach similar to the independent boson model. The role of the polaronic unitary transform is played by the scattering matrix, for which a diagrammatic, linked cluster expansion is available Similarities and differences to the independent boson model are discussed. A numerical example is presented.

10. Controlling Single Molecule Conductance by a Locally Induced Chemical Reaction on Individual Thiophene Units

Authors: Michnowicz, T; Borca, B; Petuya, R; Schendel, V; Pristl, M; Pentegov, I; Kraft, U; Klauk, H; Wahl, P; Mutombo, P; Jelinek, P; Arnau, A; Schlickum, U; Kern, K

Published: , DOI: 10.1002/anie.201915200

Abstract: Among the prerequisites for the progress of single-molecule-based electronic devices are a better understanding of the electronic properties at the individual molecular level and the development of methods to tune the charge transport through molecular junctions. Scanning tunneling microscopy (STM) is an ideal tool not only for the characterization, but also for the manipulation of single atoms and molecules on surfaces. The conductance through a single molecule can be measured by contacting the molecule with atomic precision and forming a molecular bridge between the metallic STM tip electrode and the metallic surface electrode. The parameters affecting the conductance are mainly related to their electronic structure and to the coupling to the metallic electrodes. Here, the experimental and theoretical analyses are focused on single tetracenothiophene molecules and demonstrate that an in situ-induced direct desulfurization reaction of the thiophene moiety strongly improves the molecular anchoring by forming covalent bonds between molecular carbon and copper surface atoms. This bond formation leads to an increase of the conductance by about 50 % compared to the initial state.

PhD. Neatu Florentina

Scientific researcher, 2st degree