Works matching DE "ELECTRONIC excitation"
Results: 2706
Olga Pavlovna Burmistrova: November 19, 1952 – September 14, 2024.
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- Pharmaceutical Chemistry Journal, 2024, v. 58, n. 9, p. 1361, doi. 10.1007/s11094-025-03282-7
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- Article
The development and applications of multidimensional biomolecular spectroscopy illustrated by photosynthetic light harvesting.
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- Quarterly Reviews of Biophysics, 2024, v. 57, p. 1, doi. 10.1017/S003358352400009X
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- Article
Direct Statistical Simulation of Radiation behind the Shock Wave Front in a CO<sub>2</sub> and N<sub>2</sub> Mixture.
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- Fluid Dynamics, 2024, v. 59, n. 5, p. 1552, doi. 10.1134/S001546282460425X
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On Resonance for Nuclear Excitation by Atomic Electron Transitions during Collisions of Atoms in a Plasma.
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- Physics of Atomic Nuclei, 2024, v. 87, n. 9, p. 1286, doi. 10.1134/S1063778824090175
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Grey Excitation Controller for Synchronous Generator.
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- Journal of Grey System, 2004, v. 16, n. 1, p. 51
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- Article
Direction of arrival estimation of Lamb waves using circular arrays.
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- Structural Health Monitoring, 2011, v. 10, n. 5, p. 467, doi. 10.1177/1475921710379512
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Attribute-Based Key-Insulated Encryption.
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- Journal of Information Science & Engineering, 2011, v. 27, n. 2, p. 437
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- Article
Design of a robust nonlinear controller for a synchronous generator connected to an infinite bus.
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- Complexity, 2016, v. 21, n. 5, p. 203, doi. 10.1002/cplx.21648
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Excitation of electrostatic lower hybrid wave by nonlinear interaction of hermite cosh-gaussian and cosh-gaussian laser beams in collisional plasma embedded with static magnetic field.
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- Optical & Quantum Electronics, 2024, v. 56, n. 10, p. 1, doi. 10.1007/s11082-024-07584-0
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- Article
Quantum chemical calculations on cyclobutane coupling of 7–hydroxy–4–methyl coumarin.
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- Optical & Quantum Electronics, 2024, v. 56, n. 9, p. 1, doi. 10.1007/s11082-024-07371-x
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- Article
Diffusive decay of collective quantum excitations in electron gas.
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- Optical & Quantum Electronics, 2024, v. 56, n. 7, p. 1, doi. 10.1007/s11082-024-07186-w
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- Article
Exploring sin-Gaussian laser pulses for efficient electron acceleration in plasma.
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- Optical & Quantum Electronics, 2024, v. 56, n. 4, p. 1, doi. 10.1007/s11082-023-06262-x
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- Article
Excitation of electron Bernstein wave by nonlinear interaction of two copropagating Hermite–Gaussian laser beams in collisional plasma with static magnetic field.
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- Optical & Quantum Electronics, 2023, v. 55, n. 7, p. 1, doi. 10.1007/s11082-023-04883-w
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- Article
Designing four naphthalene di-imide based small organic solar cells with 5,6-difluoro-3-oxo-2,3-dihydro-indene non-fullerene acceptors.
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- Optical & Quantum Electronics, 2021, v. 53, n. 9, p. 1, doi. 10.1007/s11082-021-03209-y
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- Article
Optical guiding of intense Hermite–Gaussian laser beam in preformed plasma channel and second harmonic generation.
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- Optical & Quantum Electronics, 2021, v. 53, n. 8, p. 1, doi. 10.1007/s11082-021-03046-z
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- Article
Temperature-dependent spectral response mechanism in GaAs-based blocked-impurity-band (BIB) far-infrared detectors.
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- Optical & Quantum Electronics, 2020, v. 52, n. 1, p. 1, doi. 10.1007/s11082-019-2150-z
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Molecular design of D–A–D conjugated molecules based on fluorene for organic solar cells.
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- Optical & Quantum Electronics, 2019, v. 51, n. 3, p. N.PAG, doi. 10.1007/s11082-019-1799-7
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XRF and TXRF techniques for multi-element determination of trace elements in whole blood and human hair samples.
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- Journal of Radioanalytical & Nuclear Chemistry, 2007, v. 273, n. 2, p. 435, doi. 10.1007/s10967-007-6869-9
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Broadband Ultrafast Electron Microscopy Using Electrically Driven Pulse Generation.
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- 2023
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- Abstract
Monochromated Electron Energy-Loss Spectroscopy of Interfaces in Beam Sensitive Materials.
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- Microscopy & Microanalysis, 2019, p. 1986, doi. 10.1017/S1431927618010413
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Electron Irradiation-Induced Defects and Phase Transformations in Two-Dimensional Transition Metal Dichalcogenides.
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- Microscopy & Microanalysis, 2019, p. 1592, doi. 10.1017/S1431927618008449
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- Article
Aloof-beam Vibrational Electron Energy-loss Spectroscopy of Adsorbate/Metal Particle Systems.
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- Microscopy & Microanalysis, 2019, p. 460, doi. 10.1017/S1431927618002799
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- Article
Effect of donor and acceptor on optoelectronic properties of benzo[1,2-b:4,5-b′]dithiophene.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2021, v. 140, n. 12, p. 1, doi. 10.1007/s00214-021-02855-5
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- Article
Excitation energies through Becke's exciton model within a Cartesian-grid KS DFT.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2021, v. 140, n. 1, p. 1, doi. 10.1007/s00214-020-02699-5
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- Article
Tautomeric effect of guanine on stability, spectroscopic and absorbance properties in cytosine–guanine base pairs: a DFT and TD-DFT perspective.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 2, p. 1, doi. 10.1007/s00214-020-2551-x
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- Article
Adaptive aromaticity in ruthenacycles.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 2, p. 1, doi. 10.1007/s00214-019-2537-8
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- Article
Scaling exchange and correlation in the on-top density functional of multiconfiguration pair-density functional theory: effect on electronic excitation energies and bond energies.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 2, p. 1, doi. 10.1007/s00214-019-2539-6
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Simple computational screening of potential singlet fission molecules.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2018, v. 137, n. 8, p. 1, doi. 10.1007/s00214-018-2290-4
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- Article
Low-lying electronic excitations of a water-soluble BODIPY: from the gas phase to the solvated molecule.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 12, p. 1, doi. 10.1007/s00214-016-2011-9
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Electronic spectroscopy of a solvatochromic dye in water: comparison of static cluster/implicit and dynamical/explicit solvent models on structures and energies.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 12, p. 1, doi. 10.1007/s00214-016-2009-3
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Electronic excitation and ionization behavior of N-hydroxypyridine-2(1H)-thione and its deprotonated anion in a polarizable medium studied using quantum chemical computations.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 4, p. 1, doi. 10.1007/s00214-016-1870-4
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Electric properties of the low-lying excited states of benzonitrile: geometry relaxation and solvent effects.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2015, v. 134, n. 6, p. 1, doi. 10.1007/s00214-015-1678-7
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- Article
Comparison between hybrid functionals free of adjustable parameters and symmetry-adapted cluster–configuration interaction for electronically excited states of organic compounds: TD-PBE0-1/3 is better than expected.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2015, v. 134, n. 5, p. 1, doi. 10.1007/s00214-015-1672-0
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- Article
How to choose the frozen density in Frozen-Density Embedding Theory-based numerical simulations of local excitations?
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2014, v. 133, n. 1, p. 1, doi. 10.1007/s00214-013-1405-1
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- Article
MS-CASPT2 study of the low-lying electronic excited states of di-thiosubstituted formic acid dimers.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2013, v. 132, n. 3, p. 1, doi. 10.1007/s00214-013-1338-8
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Metal-to-metal charge-transfer transitions: reliable excitation energies from ab initio calculations.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 9, p. 1, doi. 10.1007/s00214-012-1264-1
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- Article
Accurate time-dependent density functional theory calculations of the near edge X-ray absorption fine structure of large systems.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 9, p. 1, doi. 10.1007/s00214-012-1267-y
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Relativistic segmented contraction basis sets with core-valence correlation effects for atoms La through Lu: Sapporo-DK- nZP sets ( n = D, T, Q).
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 7, p. 1, doi. 10.1007/s00214-012-1247-2
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- Article
Thermal and environmental effects on Oligothiophene low-energy singlet electronic excitations in dilute solution: a theoretical and experimental study.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 3, p. 1, doi. 10.1007/s00214-012-1177-z
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- Article
Is the dynamical polarization a significant part of the contribution of the triples to the correlation energy?
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 3, p. 1, doi. 10.1007/s00214-012-1156-4
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Time-dependent density functional theory benchmarking for the calculations of atomic spectra: efficiency of exc-ETDZ basis set.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 3, p. 1, doi. 10.1007/s00214-012-1148-4
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Theoretical investigation for spectroscopic constants of ground-state alkaline-earth dimers with high accuracy.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 2, p. 1, doi. 10.1007/s00214-012-1117-y
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Low-lying electronic excitations and optical absorption spectra of the black dye sensitizer: a first-principles study.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 2, p. 1, doi. 10.1007/s00214-012-1115-0
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Theoretical reference values for the AE6 and BH6 test sets from explicitly correlated coupled-cluster theory.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2012, v. 131, n. 2, p. 1, doi. 10.1007/s00214-012-1112-3
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Theoretical studies on a new pattern of laser-driven systems: towards elucidation of direct photo-injection in dye-sensitized solar cells.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 130, n. 2/3, p. 227, doi. 10.1007/s00214-011-0963-3
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Relativistic effects in low-lying electronic states of iron.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 129, n. 3-5, p. 561, doi. 10.1007/s00214-011-0898-8
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The effect of local approximations on first-order properties from expectation-value coupled cluster theory.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 129, n. 1, p. 15, doi. 10.1007/s00214-010-0872-x
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Electronic spectrum of FCO: theoretical calculations of vertical excitation energies and intensities.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 129, n. 1, p. 53, doi. 10.1007/s00214-010-0884-6
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- Article
Modeling quantum vibrational excitations in condensed-phase molecular systems.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 129, n. 1, p. 31, doi. 10.1007/s00214-010-0882-8
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- Article
Laser control of double proton transfer in porphycenes: towards an ultrafast switch for photonic molecular wires.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 128, n. 3, p. 307, doi. 10.1007/s00214-010-0847-y
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