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Fine Structure Investigation and Laser Cooling Study of the CdBr Molecule. [PDF]
Int J Mol SciMostafa A +4 more
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Computational study on B, N, and Si-doped C60 nanocages for acetone detection in heart failure diagnosis and environmental remediation. [PDF]
Sci RepAlamri A, Alafnan A.
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Plasmonic tuning of dark-exciton radiation dynamics and far-field emission directionality in monolayer WSe<sub>2</sub>. [PDF]
Sci AdvJin S +10 more
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The Journal of Physical Chemistry A, 2023
We develop response-function algorithms for dipole moments and transition dipole moments for compressed multistate pair-density functional theory (CMS-PDFT). We use the method of undetermined Lagrange multipliers to derive analytical expressions and validate them using numerical differentiation.
Aleksandr O. Lykhin +3 more
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We develop response-function algorithms for dipole moments and transition dipole moments for compressed multistate pair-density functional theory (CMS-PDFT). We use the method of undetermined Lagrange multipliers to derive analytical expressions and validate them using numerical differentiation.
Aleksandr O. Lykhin +3 more
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Dipole Moment Operator and Spectral Parameters of Torsion Transitions
Russian Physics Journal, 2021zbMATH Open Web Interface contents unavailable due to conflicting licenses.
Turovtsev, V. V. +3 more
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Dipole Transition Moments of Chromate Ion
The Journal of Chemical Physics, 1970A LCAO–MO parametric calculation of chromate ion in terms of a single quantity β, the ligand mixing coefficient, has been carried out. The values of both dipole length (QtheoretL) and dipole velocity (QtheoretV) transition moments for A11 → 1T2 (t1 → 2e) transition of the chromate ion have been computed as functions of ligand mixing coefficient on the ...
S. P. Tandon, S. S. L. Surana
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Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2016
The analytic potential energy functions (APEFs) of the X(1)Σ(+), 2(1)Σ(+), a(3)Σ(+), and 2(3)Σ(+) states of the LiRb molecule are obtained using Morse long-range potential energy function with damping function and nonlinear least-squares method. These calculations were based on the potential energy curves (PECs) calculated using the multi-reference ...
Yang, You +5 more
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The analytic potential energy functions (APEFs) of the X(1)Σ(+), 2(1)Σ(+), a(3)Σ(+), and 2(3)Σ(+) states of the LiRb molecule are obtained using Morse long-range potential energy function with damping function and nonlinear least-squares method. These calculations were based on the potential energy curves (PECs) calculated using the multi-reference ...
Yang, You +5 more
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Transition dipole moments of the lithium dimer
Atomic Data and Nuclear Data Tables, 2013In addition to knowledge of interatomic adiabatic potential energy curves of diatomic systems, it is essential to know electronic transition dipole moments. They are needed in understanding processes like photodissociation, photoassociation, cooling, and trapping.
Patryk Jasik, Józef E. Sienkiewicz
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The transition dipole moment representation and spectral phasors
Multiphoton Microscopy in the Biomedical Sciences XXI, 2021Spectral phasors are currently based on fluorescence spectra in the wavelength domain. However, this is a problem when using spectral phasors to quantify emitters since wavelength represented spectra are not proportional to emitter population. Here we show the effect of unmixing using spectra in their transition dipole moment representation for a ...
Jessica Kline, Marcos Dantus
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