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International Journal of Quantum Chemistry, ISSN 0020-7608, 02/2020, Volume 120, Issue 3, p. n/a
The turn‐on luminescent chemosensor [2‐Hydroxy‐1‐naphthaldehyde‐(2‐pyridyl) hydrazone] (L), selective to Al3+ ions, was studied by means of density functional... 
TICT | CHEF | TD‐DFT | fluorescence | PET | NICKEL-COMPLEXES | QUANTUM SCIENCE & TECHNOLOGY | PHOTOINDUCED ELECTRON-TRANSFER | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | STATE | IONS | INTRAMOLECULAR CHARGE-TRANSFER | MATHEMATICS, INTERDISCIPLINARY APPLICATIONS | SCHIFF-BASE | CHEMICAL VALENCE | DENSITY-FUNCTIONAL THEORY | SELECTIVE DETECTION | TD-DFT | NATURAL ORBITALS
Journal Article
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, ISSN 1463-9076, 01/2020, Volume 22, Issue 2, pp. 748 - 757
Copper(i) bis-phenanthroline complexes represent Earth-abundant alternatives to ruthenium-based sensitizers for solar energy conversion and photocatalysis.... 
QUANTUM DYNAMICS | MOLECULAR-DYNAMICS | SPECTROSCOPY | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | X-RAY | CHEMISTRY, PHYSICAL | SYSTEMS | RELAXATION | PHOTOPHYSICAL PROPERTIES | EMISSION | CU(I) COMPLEXES | PHOTOINDUCED STRUCTURAL-CHANGE
Journal Article
NATURE COMMUNICATIONS, ISSN 2041-1723, 05/2019, Volume 10, Issue 1, pp. 2104 - 14
Protein-induced fluorescence enhancement (PIFE) is a popular tool for characterizing protein-DNA interactions. PIFE has been explained by an increase in local... 
CARBOCYANINES | SINGLE | SPECIFICITY | PHOTOISOMERIZATION | CYANINE DYE | MULTIDISCIPLINARY SCIENCES | ENHANCEMENT | PHOTOPHYSICS | VISCOSITY | PHOTOINDUCED ISOMERIZATION | PIFE | Viscosity | Proteins | Dyes | Experimental design | Fluorescence | Design of experiments | Deoxyribonucleic acid--DNA | Quenching | Obsolescence
Journal Article
NATURE COMMUNICATIONS, ISSN 2041-1723, 08/2019, Volume 10, Issue 1, pp. 3606 - 8
Disentangling the strong interplay between electronic and nuclear degrees of freedom is essential to achieve a full understanding of excited state processes... 
QUANTUM DYNAMICS | MULTIDISCIPLINARY SCIENCES | FREE-ELECTRON LASER | PHOTOPHYSICS | ABSORPTION SPECTROSCOPY | K-EDGE | EXCITED-STATE DYNAMICS | PHOTOINDUCED STRUCTURAL-CHANGE | SINGLET | Potential energy | Femtosecond | Organic chemistry | Energy flow | Sensitivity | Tracking | Chemical reactions | X-ray spectroscopy | Copper | X ray absorption | Complexity
Journal Article
NANO LETTERS, ISSN 1530-6984, 11/2019, Volume 19, Issue 11, pp. 8216 - 8224
Journal Article
JOURNAL OF NON-CRYSTALLINE SOLIDS, ISSN 0022-3093, 11/2019, Volume 523, p. 119597
Structural changes developed in Ge-S glassy alloy with incorporation of Ga have been investigated using vibrational spectroscopy. Thermal evaporation technique... 
SPECTROSCOPIC ANALYSIS | MATERIALS SCIENCE, MULTIDISCIPLINARY | OPTICAL-PROPERTIES | MATERIALS SCIENCE, CERAMICS | Chalcogenide glasses | Vibrational spectroscopy | RAMAN-SCATTERING | COMPOSITIONAL DEPENDENCE | RANGE ORDER | Raman and FTIR spectra | XPS | X-ray photoelectron spectroscopy | PHOTOINDUCED CHANGES
Journal Article
Chemistry – A European Journal, ISSN 0947-6539, 10/2019, Volume 25, Issue 55, pp. 12730 - 12739
Journal Article
Dyes and Pigments, ISSN 0143-7208, 09/2019, Volume 168, pp. 235 - 247
Journal Article
ACS ENERGY LETTERS, ISSN 2380-8195, 07/2019, Volume 4, Issue 7, pp. 1579 - 1583
Organic metal halide hybrids with zero-dimensional (OD) structure at the molecular level, or single-crystalline bulk assemblies of metal halides, are an... 
ELECTROCHEMISTRY | ENERGY & FUELS | MATERIALS SCIENCE, MULTIDISCIPLINARY | PHOSPHORESCENT MOLECULAR BUTTERFLIES | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | DIODES | PEROVSKITES | PHOTOINDUCED STRUCTURAL-CHANGE | INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
Journal Article
INORGANIC CHEMISTRY, ISSN 0020-1669, 06/2019, Volume 58, Issue 12, pp. 7730 - 7745
Three new copper(I) complexes [Cu-(L-x)(2)](+)(PF6-) (where L-x stands for 2,9-dihalo-1,10-phenanthroline and X = Cl, Br, and I) have been synthesized in order... 
1,10-PHENANTHROLINE | COPPER(I) COMPLEXES | TEMPERATURE-DEPENDENCE | TRANSFER EXCITED-STATES | X-RAY | DYNAMICS | PHOTOCHEMISTRY | ABSORPTION | CU(I) COMPLEXES | PHOTOINDUCED STRUCTURAL-CHANGE | CHEMISTRY, INORGANIC & NUCLEAR | or physical chemistry | Chemical Sciences | Coordination chemistry | Theoretical and
Journal Article
APPLIED SCIENCES-BASEL, ISSN 2076-3417, 06/2019, Volume 9, Issue 12, p. 2461
Journal Article
Journal of Physical Chemistry C, ISSN 1932-7447, 05/2019, Volume 123, Issue 20, pp. 12684 - 12693
Heterovalent Bi doping in lead halide perovskites has shown increased stability and high power conversion efficiency (PCE), yet the exact role it played... 
SOLAR-CELLS | STABILITY | MATERIALS SCIENCE, MULTIDISCIPLINARY | NANOCRYSTALS | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | PHOTOINDUCED STRUCTURAL-CHANGE | SINGLE-CRYSTALS | RAY-DETECTORS | HOLE TRANSPORT MATERIALS | CARRIER LIFETIME | PAIR CREATION ENERGY | EFFICIENT
Journal Article
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, ISSN 1948-7185, 05/2019, Volume 10, Issue 10, pp. 2475 - 2480
Thermally activated delayed fluorescence (TADF) molecules are gathering attention for their potential to boost the efficiency of organic light-emitting diodes... 
INFRARED VIBRATIONAL SPECTROSCOPY | PHOTOINDUCED PHASE-TRANSITION | MATERIALS SCIENCE, MULTIDISCIPLINARY | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | DYNAMICS | BENZOPHENONE | CHEMISTRY, PHYSICAL | NANOSCIENCE & NANOTECHNOLOGY | INTRAMOLECULAR CHARGE-TRANSFER
Journal Article
Advanced Materials, ISSN 0935-9648, 05/2019, Volume 31, Issue 19, pp. e1900652 - n/a
Among functional organic materials, low‐dimensional molecular crystals represent an intriguing class of solids due to their tunable electronic, magnetic, and... 
ultrafast electron diffraction | structural dynamics | organic molecular conductors | photoinduced phase transitions | Organic conductors | Conduction bands | Single crystals | Ion charge | Quantum efficiency | Organic materials | Pathways | Electron diffraction | Conductors | Temporal resolution | Charge transfer | Phase transitions | Functional materials
Journal Article
Advanced Theory and Simulations, ISSN 2513-0390, 05/2019, Volume 2, Issue 5, pp. 1800192 - n/a
Spin‐crossover (SCO) and Prussian blue analogs (PBAs) materials are investigated in 2D with a three‐state Blume–Emery–Griffiths (BEG) model where each spin... 
kinetic Monte Carlo simulations | phase diagram | 2D‐nucleation | dynamic mean field approach | relaxation dynamics | spin‐crossover compounds | CONVERSION | MULTIDISCIPLINARY SCIENCES | spin-crossover compounds | ISING SYSTEM | TEMPERATURE | 2-STEP | 2D-nucleation | PHASE-TRANSITION | PHOTOINDUCED MAGNETIZATION
Journal Article
Macromolecular Chemistry and Physics, ISSN 1022-1352, 05/2019, Volume 220, Issue 10, pp. 1900116 - n/a
Journal Article