1 Design and Synthesis of Gold-Gadolinium-Core-Shell Nanoparticles as Contrast Agent: a Smart Way to Future Nanomaterials for Nanomedicine Applications.

2 Mechanistic correlation between water infiltration and framework hydrophilicity in MFI zeolites.

3 Topological and electrostatic properties of diclofenac molecule as a non-steroidal anti-inflammatory drug: An experimental and theoretical study

4 The structure of protonated 3-pyridyl-substituted 5-amino-1H-1,2,4-triazoles: An experimental and theoretical study

5 Theoretical Study on Sandwich-Like Transition-Metal-Cyclooctatetraene Clusters and One-Dimensional Infinite Molecular Wires.

6 Experimental research and theoretical study of cesium, oxygen activation on defect AlGaN (0001) surface

7 Pyridine vs N-Hydrogenated Pyridine Moieties: Theoretical Study of Stability and Spectroscopy of Nitrogen-Contained Heterocyclic Aromatic Compounds and Graphene Nanoflakes.

8 Theoretical study of energy levels and transitions 4s24p3-4s4p4 for ions Rh XⅢ to Cd XVI

9 Theoretical study of the frequency shift in bimodal FM-AFM by fractional calculus

10 Dynamics and stability of a concentric compound particle - a theoretical study.

11 Theoretical Study of Palladium Membrane Reactor Performance During Propane Dehydrogenation Using CFD Method

12 High-Performance Two-Dimensional InSe Field-Effect Transistors with Novel Sandwiched Ohmic Contact for Sub-10 nm Nodes: a Theoretical Study.

13 Theoretical study on two-dimensional aerodynamic characteristics of unsteady wings.

14 Theoretical study of heat pump system using CO2/dimethylether as refrigerant

15 Theoretical study on the efficiency of utilization of nanoclay-CFRP composite materials in the root area of wind turbine blades

16 Ring expansion of alkylidenecarbenes derived from lactams, lactones, and thiolactones into strained heterocyclic alkynes: A theoretical study

17 Comparisons Between Tridentate Bis(benzazoles)-pyridine and Bis(benzazoles)triazine Ligands: a Theoretical Study

18 Theoretical Study of the Effect of Different π Bridges Including an Azomethine Group in Triphenylamine-Based Dye for Dye-Sensitized Solar Cells.

19 Optimized geometry, vibration (IR and Raman) spectra and nonlinear optical activity of p-nitroanilinium perchlorate molecule: A theoretical study

20 Count rate capabilities of polycrystalline silicon photon counting detectors for CBCT applications - A theoretical study.

21 Aerosol mass yields of selected biogenic volatile organic compounds - A theoretical study with nearly explicit gas-phase chemistry

22 Theoretical study for the inhibition ability of some bioactive imidazole derivatives against the Middle-East respiratory syndrome corona virus (MERS-Co)

23 Experimental and theoretical study of the formation process of photopolymer based self-written waveguides.

24 Heteroatom-bridged heterofluorenes: a theoretical study on molecular structures and optoelectronic properties.

25 Revealing stable geometries and magic clusters of hexagonal boron nitride in the nucleation of chemical vapor deposition growth on Ni(111)/Cu(111) surfaces: a theoretical study.

26 A theoretical study on the metal-free triazole formation through tandem [3+2] cycloaddition/retro-Diels-Alder reaction of benzyl azide and oxanorbornadienedicarboxylate.

27 Local order and cluster formation in model fluids with competing interactions: a simulation and theoretical study.

28 A Theoretical study on the degradation of 2-mercaptobenzothiazole and 2-mercaptobenzimidazole by [rad]OH in vacuo and aqueous media

29 Theoretical study on the sensing mechanism of an ON-OFF-ON type fluoride fluorescent chemosensor.

30 Plasma Surface Polymerized and Biomarker Conjugated Boron Nitride Nanoparticles for Cancer-Specific Therapy: Experimental and Theoretical Study

31 A Theoretical Study on the Hydrodynamics of a Zero-Pressurized Air-Cushion-Assisted Barge Platform

32 new biscoumarin derivatives: synthesis, crystal structure, theoretical study and antibacterial activity against staphylococcus aureus

33 a theoretical study on seasonality

34 theoretical study on the reaction mechanism of cyclopropenylidene with cyclic cnh2no (n = 2, 3) compounds: ring expansion process

35 a comparative theoretical study of picric acid and its cocrystals

36 in lesbian, gay and bisexual individuals: attachment, self-compassion and internalized homophobia: a theoretical study

37 a theoretical study of 1,4-bis (3-carboxy-3-oxo-prop-1-enyl) benzene i

38 biogenesis of triterpene dimers from orthoquinones related to quinonemethides: theoretical study on the reaction mechanism

39 theoretical study about the effect of halogen substitution on the reactivity of antitumor 3-formylchromones and their free radicals

40 theoretical study of the interaction between vanadium oxide and hy-zeolite elucidating loss activity of the catalyst

41 experimental and theoretical study of the interactions between fe2o3/al2o3 and co

42 degradation kinetics of calcium polyphosphate bioceramic: an experimental and theoretical study

43 brand value of innovative companies – a theoretical study

44 microwave assisted synthesis, antifungal activity and dft theoretical study of some novel 1,2,4-triazole derivatives containing the 1,2,3-thiadiazole moiety

45 mechanism investigation of the reaction between triphenylphosphine, dialkyl acetylenedicarboxylates and 2-hydroxybenzimidazole: experimental and theoretical study

46 theoretical study of a chain sliding on a fixed support

47 the nature of interactions between [cu2cl3]−-based ionic liquid and thiophene – a theoretical study

48 estudo teórico das transições eletrônicas usando métodos simples e sofisticados theoretical study of electronic transitions using simple and sophisticated methods

49 some nitrogen-rich heterocycles derivatives as potential explosives and propellants: a theoretical study

50 theoretical study of the intramolecular proton transfer and calculation of the nucleus independent chemical shift in juglone and some of its derivatives

51 theoretical study on the second hyperpolarizailities of oligomeric systems composed of carbon and silicon π-structures

52 structural, vibrational, and electronic properties of the glucoalkaloid strictosidine: a combined experimental and theoretical study

53 theoretical study on synchronous characterization of surface and interfacial mechanical properties of thin-film/substrate systems with residual stress based on pressure blister test technique

54 theoretical study of upper critical magnetic field (hc2) in multiband iron based superconductors

55 synthesis, characterization, and photocatalysis of fe-doped : a combined experimental and theoretical study

56 enantioselective synthesis of b-amino acids. 12. experimental and theoretical study of the diastereoselectivity of alkylation of the dianion of n',n'-bis(a-phenylethyl)-n -carbobenzyloxypropionamide

57 structure and raman spectra of c60 and c70 fullerenes encased into single-walled boron nitride nanotubes: a theoretical study

58 Experimental and Theoretical Study into Interface Structure and Band Alignment of the CuZn Cd SnS Heterointerface for Photovoltaic Applications.

59 Theoretical study on the ESIPT processes and fluorescence properties of 2-(1H-Benzimidazol-2-yl)phenol-based derivatives

60 Influence of the anions on the structure and magnetic properties of a series of bis(μ-diphenoxo)-bridged linear trinuclear copper(II) complexes: an experimental and theoretical study

61 Hydrogen and deuterium separation on metal organic frameworks based on Cu- and Zn-BTC: an experimental and theoretical study

62 Influence of the anions on the structure and magnetic properties of a series of bis(Î¼-diphenoxo)-bridged linear trinuclear copper(II) complexes: an experimental and theoretical study

63 Stability and acidity contributions of heteropolymetalates: a theoretical study of the Keggin and Dawson ions

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