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Crystal Chemistry of Zinc, Cadmium and Mercury
| Crystal Chemistry of Zinc, Cadmium and Mercury |
| Autore | Weil Matthias |
| Pubbl/distr/stampa | MDPI - Multidisciplinary Digital Publishing Institute, 2019 |
| Descrizione fisica | 1 electronic resource (156 p.) |
| Soggetto non controllato |
hydroxyl group
bis(1 quinaldinic acid solidification xanthate wurtzite mechanical EBSD oxo-centred polyhedra coordination polymer precipitation 5-thiophenedicarboxylic acid defects in semiconductors zinc(II) complexes precursor nanometer zinc oxide zinc thermal analysis transmission electron microscopy (TEM) crystal chemistry pyridine dithiocarbamate high magnetic field index of X-ray powder diffraction data 1 hydrogen bonding 2 luminescence cadmium interface structure 3-bis(1 mercury aqueous solution method crystallography growth mechanism PL spectra phonon dispersion coordination polymers 4-triazol-1-yl)propane CdZnTe oxochromates(VI) Ni3Sn structure type structural chemistry dithiophosphates traveling heater method ZnO nanorod arrays copper amalgams dental amalgams unusual coordination modes CdS zinc-rich crystal 4-triazol-1-yl)methane elastic crystal structure phonon bitopic ligand room-temperature solid state reaction zinc complex characterization crystal engineering ZnS hydrogen bond |
| Formato | Materiale a stampa  |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNINA-9910346838303321 |
Weil Matthias
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| MDPI - Multidisciplinary Digital Publishing Institute, 2019 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
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The Application of Quantum Mechanics in Reactivity of Molecules
| The Application of Quantum Mechanics in Reactivity of Molecules |
| Autore | Sousa Sérgio F |
| Pubbl/distr/stampa | Basel, Switzerland, : MDPI - Multidisciplinary Digital Publishing Institute, 2021 |
| Descrizione fisica | 1 electronic resource (182 p.) |
| Soggetto topico | Research & information: general |
| Soggetto non controllato |
Pyrophosphate
electronic structure mechanical properties optical properties first-principles calculations chemical reactivity theory HSAB principle information theory quantum mechanics regional complementarity rule virial theorem free radical scavengers antioxidants fluoxetine depressive disorder major oxidative stress DFT calculations reactive oxygen species porphyrins, density functional theory DFT surfaces self-assembly scanning tunneling microscopy dispersion nanostructures solid state condensed phase [NiFeSe] hydrogenase quantum mechanics (QM)/molecular mechanics (MM), geometry optimizations vibrational frequency analyses Fourier transform infrared (FTIR) frequencies Quercetin molecule conformational mobility hydroxyl group transition state concerted rotation of the hydroxyl groups quantum-chemical calculations quantum technology chemical kinetics reaction rate RRKM theory master equation coordination complexes donor-acceptor systems partial electronic flows phase-current relations subsystem phases |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Record Nr. | UNINA-9910557762903321 |
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Sousa Sérgio F
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| Basel, Switzerland, : MDPI - Multidisciplinary Digital Publishing Institute, 2021 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
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