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Density functional theory of time-dependent phenomena

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Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/andp.19925040404openalex-snapshot

Response of finite many‐electron systems beyond the time‐dependent local density approximation: Application to small metal clusters

inferredcites →https://doi.org/10.1002/bbpc.19950990338openalex-snapshot

Density‐Functional Approach to Atoms in Strong Laser Pulses

inferredcites →https://doi.org/10.1002/qua.560410311openalex-snapshot

Accurate local spin‐polarized exchange potential: Reconciliation of generalized Slater and Kohn–Sham methods

inferredcites →https://doi.org/10.1007/978-1-4612-3136-3openalex-snapshot

Density Functional Methods in Chemistry

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Strongly Coupled Plasma Physics

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Super-Intense Laser-Atom Physics

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Density Functional Methods In Physics

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Metallic Surfaces and Density Functional Theory

inferredcites →https://doi.org/10.1007/978-1-4757-9975-0_9openalex-snapshot

Recent Developments in Kohn-Sham Theory for Orbital-Dependent Exchange-Correlation Energy Functionals

inferredcites →https://doi.org/10.1007/978-1-4899-1977-9openalex-snapshot

Theory of Multiphoton Processes

inferredcites →https://doi.org/10.1007/978-1-4899-2486-5openalex-snapshot

Local Density Theory of Polarizability

inferredcites →https://doi.org/10.1007/978-3-642-52803-3openalex-snapshot

Handbook of Elliptic Integrals for Engineers and Physicists

inferredcites →https://doi.org/10.1007/978-94-009-0261-9openalex-snapshot

Super-Intense Laser-Atom Physics IV

inferredcites →https://doi.org/10.1007/978-94-009-9027-2_2openalex-snapshot

Density Functional Theory of Atoms and Molecules

inferredcites →https://doi.org/10.1007/bf00548835openalex-snapshot

A density-functional calculation of dynamic dipole polarizabilities of noble gas atoms

inferredcites →https://doi.org/10.1007/bf00551551openalex-snapshot

On the calculation of multiplet energies by the hartree-fock-slater method

inferredcites →https://doi.org/10.1007/bf01024183openalex-snapshot

Theory of the local field correction in an electron gas

inferredcites →https://doi.org/10.1007/bf01344553openalex-snapshot

Bremsverm�gen von Atomen mit mehreren Elektronen

inferredcites →https://doi.org/10.1016/0003-4916(63)90078-2openalex-snapshot

Hydrodynamic equations and correlation functions

inferredcites →https://doi.org/10.1016/0009-2614(79)87292-9openalex-snapshot

Orbital functional for exchange and correlation: self-interaction correction to the local density approximation

inferredcites →https://doi.org/10.1016/0009-2614(88)87426-8openalex-snapshot

Femtosecond real-time dynamics of photofragment-trapping resonances on dissociative potential energy surfaces

inferredcites →https://doi.org/10.1016/0009-2614(92)85365-hopenalex-snapshot

Negative ions as described by Kohn—Sham exchange-only theory

inferredcites →https://doi.org/10.1016/0009-2614(94)01402-hopenalex-snapshot

A density-functional study of van der Waals forces: rare gas diatomics

inferredcites →https://doi.org/10.1016/0009-2614(95)00500-4openalex-snapshot

Density-functional theory using an optimized exchange-correlation potential

inferredcites →https://doi.org/10.1016/0010-4655(89)90034-9openalex-snapshot

A program to compute variationally optimized effective atomic potentials

inferredcites →https://doi.org/10.1016/0029-5582(64)90734-5openalex-snapshot

Elementary excitations in solids

inferredcites →https://doi.org/10.1016/0038-1098(77)91495-8openalex-snapshot

Inter-subband optical transitions in a surface space-charge layer

inferredcites →https://doi.org/10.1016/0038-1098(84)90577-5openalex-snapshot

Nonlocal density approximation to exchange and correlation in self-consistent bandstructure calculations: Application to Cu

inferredcites →https://doi.org/10.1016/0038-1098(89)90105-1openalex-snapshot

Coupled intra- and intersubband plasmon-phonons beyond the random-phase approximation in double heterostructures

inferredcites →https://doi.org/10.1016/0039-6028(91)90142-fopenalex-snapshot

The normal modes at the surface of simple metals

inferredcites →https://doi.org/10.1016/0079-6816(82)90001-6openalex-snapshot

Surface electromagnetic fields

inferredcites →https://doi.org/10.1016/0166-1280(83)85017-9openalex-snapshot

A simple density-functional calculation of frequency-dependent multipole polarizabilities of noble gas atoms

inferredcites →https://doi.org/10.1016/0301-0104(82)87030-4openalex-snapshot

Dynamic polarizability of many-electron systems within a time-dependent density-functional theory

inferredcites →https://doi.org/10.1016/0306-4549(89)90016-9openalex-snapshot

Density-functional theory of atoms and molecules

inferredcites →https://doi.org/10.1016/0375-9601(71)90994-7openalex-snapshot

Surface plasmon dispersion

inferredcites →https://doi.org/10.1016/0375-9601(87)90054-5openalex-snapshot

Atomic basis calculations for the two-electron system Li2+-H

inferredcites →https://doi.org/10.1016/0375-9601(87)90291-xopenalex-snapshot

Two-electron description of electron transfer in He++He+ collisions

inferredcites →https://doi.org/10.1016/0375-9601(90)90501-eopenalex-snapshot

Exact relations in the optimized effective potential method employing an arbitrary Exc[}ψiσ{]

inferredcites →https://doi.org/10.1016/0375-9601(90)90975-topenalex-snapshot

Derivation and application of an accurate Kohn-Sham potential with integer discontinuity

inferredcites →https://doi.org/10.1016/0375-9601(91)91005-xopenalex-snapshot

Cluster-cluster collisions. I. Reaction channels - fusion, deep inelastic and quasielastic collisions

inferredcites →https://doi.org/10.1016/0375-9601(91)91006-yopenalex-snapshot

Cluster-cluster collisions. II. Cluster molecules — a stable state of matter?

inferredcites →https://doi.org/10.1016/0375-9601(94)00702-qopenalex-snapshot

C60+ + C60 collisions I. Multifragmentation and collective flow effects

inferredcites →https://doi.org/10.1016/0375-9601(94)01012-jopenalex-snapshot

C60+ + C60 collisions. II. Mass and angular distributions

inferredcites →https://doi.org/10.1016/0375-9601(94)90035-3openalex-snapshot

A nonequilibrium time-dependent functional theory based on Liouvillean quantum field dynamics in condensed matter systems

inferredcites →https://doi.org/10.1016/0375-9601(94)90966-0openalex-snapshot

A time-dependent functional theory for the electron-ion system

inferredcites →https://doi.org/10.1016/c2009-0-14269-1openalex-snapshot

Strongly Coupled Plasma Physics

inferredcites →https://doi.org/10.1016/s0065-3276(08)60600-0openalex-snapshot

Time-Dependent Density-Functional Theory

inferredcites →https://doi.org/10.1016/s0081-1947(08)60116-2openalex-snapshot

Correlations in Electron Liquids

inferredcites →https://doi.org/10.1021/cr00031a008openalex-snapshot

Perturbation Theory Approach to Intermolecular Potential Energy Surfaces of van der Waals Complexes

inferredcites →https://doi.org/10.1051/jphys:01985004605071900openalex-snapshot

Charge exchange in Li2+(1s) + H(ls) collisions. a molecular approach including two-electron translation factors

inferredcites →https://doi.org/10.1063/1.443611openalex-snapshot

Schrödinger fluid dynamics of many-electron systems in a time-dependent density-functional framework

inferredcites →https://doi.org/10.1063/1.446637openalex-snapshot

Variation-perturbation theory within a time-dependent Kohn–Sham formalism: An application to the determination of multipole polarizabilities, spectral sums, and dispersion coefficients

inferredcites →https://doi.org/10.1063/1.456377openalex-snapshot

A quantum mechanical study of predissociation dynamics of NaI excited by a femtosecond laser pulse

inferredcites →https://doi.org/10.1063/1.460327openalex-snapshot

Born–Oppenheimer dynamics using density-functional theory: Equilibrium and fragmentation of small sodium clusters

inferredcites →https://doi.org/10.1063/1.460619openalex-snapshot

Interpretation of the Fermi hole curvature

inferredcites →https://doi.org/10.1063/1.464444openalex-snapshot

Alternative expressions for the Fermi hole curvature

inferredcites →https://doi.org/10.1063/1.469994openalex-snapshot

A density functional theory study of frequency-dependent polarizabilities and Van der Waals dispersion coefficients for polyatomic molecules

inferredcites →https://doi.org/10.1070/pu1980v023n01abeh004860openalex-snapshot

The dielectric constant of an interacting electron gas

inferredcites →https://doi.org/10.1071/ph930391openalex-snapshot

Plasmons on Wide Epitaxially-grown Quantum Wells

inferredcites →https://doi.org/10.1073/pnas.76.12.6062openalex-snapshot

Universal variational functionals of electron densities, first-order density matrices, and natural spin-orbitals and solution of the v -representability problem

inferredcites →https://doi.org/10.1080/00268979000101451openalex-snapshot

Molecular dynamics without effective potentials via the Car-Parrinello approach

inferredcites →https://doi.org/10.1080/01418639408240172openalex-snapshot

Density functional calculation of the photoabsorption spectrum of simple metal clusters: Beyond the local-density approximation and jellium model

inferredcites →https://doi.org/10.1080/09500349314551851openalex-snapshot

Atoms in Intense Laser Fields

inferredcites →https://doi.org/10.1088/0022-3719/15/33/002openalex-snapshot

Orbital self-interaction in Hartree-Fock and density functional theories

inferredcites →https://doi.org/10.1088/0022-3719/21/21/001openalex-snapshot

An additional surface plasmon mode of a bare jellium aluminium surface from self-consistent microscopic calculations

inferredcites →https://doi.org/10.1088/0022-3719/7/6/003openalex-snapshot

On the response of arbitrary finite order and its relation to imaginary-time correlation functions

inferredcites →https://doi.org/10.1088/0034-4885/42/6/001openalex-snapshot

Some surface effects in the hydrodynamic model of metals

inferredcites →https://doi.org/10.1088/0953-4075/25/3/006openalex-snapshot

High-order harmonic generation in rare gases with intense subpicosecond dye laser pulses

inferredcites →https://doi.org/10.1088/0953-8984/2/17/003openalex-snapshot

Local field corrections and the influence of exchange and correlation on the microscopic longitudinal dielectric function of copper

inferredcites →https://doi.org/10.1088/0953-8984/2/30/012openalex-snapshot

The effect of a frequency-dependent exchange and correlation kernel on the multipole surface plasmon frequency of a bare jellium aluminium surface

inferredcites →https://doi.org/10.1088/0953-8984/4/39/003openalex-snapshot

Spin-density functionals for the electron correlation energy with automatic freedom from orbital self-interaction

inferredcites →https://doi.org/10.1103/physrev.136.b864openalex-snapshot

Inhomogeneous Electron Gas

inferredcites →https://doi.org/10.1103/physrev.140.a1133openalex-snapshot

Self-Consistent Equations Including Exchange and Correlation Effects

inferredcites →https://doi.org/10.1103/physrev.186.409openalex-snapshot

Electron Correlational Effects on Plasmon Damping and Ultraviolet Absorption in Metals

inferredcites →https://doi.org/10.1103/physrev.188.1375openalex-snapshot

Optical Absorption of Solid Krypton and Xenon in the Far Ultraviolet

inferredcites →https://doi.org/10.1103/physrev.90.317openalex-snapshot

A Variational Approach to the Unipotential Many-Electron Problem

inferredcites →https://doi.org/10.1103/physreva.14.36openalex-snapshot

Optimized effective atomic central potential

inferredcites →https://doi.org/10.1103/physreva.20.1693openalex-snapshot

Local-density theory of multiplet structure

inferredcites →https://doi.org/10.1103/physreva.21.1561openalex-snapshot

Density-functional approach to local-field effects in finite systems: Photoabsorption in the rare gases

inferredcites →https://doi.org/10.1103/physreva.24.1661openalex-snapshot

Time-dependent extension of the Hohenberg-Kohn-Levy energy-density functional

inferredcites →https://doi.org/10.1103/physreva.24.680openalex-snapshot

Orthonormal orbitals for the representation of an arbitrary density

inferredcites →https://doi.org/10.1103/physreva.26.1200openalex-snapshot

Electron densities in search of Hamiltonians

inferredcites →https://doi.org/10.1103/physreva.26.2243openalex-snapshot

Time-dependent Kohn-Sham density-functional theory

inferredcites →https://doi.org/10.1103/physreva.28.544openalex-snapshot

New approach to the calculation of density functionals

inferredcites →https://doi.org/10.1103/physreva.29.2909openalex-snapshot

Self-consistent time-dependent, Hartree-Fock calculation for a reactive molecular collision

inferredcites →https://doi.org/10.1103/physreva.29.625openalex-snapshot

Time-dependent local-density theory of dielectric effects in small molecules

inferredcites →https://doi.org/10.1103/physreva.30.1120openalex-snapshot

Stabilization of solutions and the Green's function for coupled-channel equations

inferredcites →https://doi.org/10.1103/physreva.30.2597openalex-snapshot

Ground-state-energy theorem and the virial theorem of a many-particle system in d dimensions

inferredcites →https://doi.org/10.1103/physreva.30.3289openalex-snapshot

Sum rules and static local-field corrections of electron liquids in two and three dimensions

inferredcites →https://doi.org/10.1103/physreva.31.1950openalex-snapshot

Hohenberg-Kohn theorem for time-dependent ensembles

inferredcites →https://doi.org/10.1103/physreva.31.3970openalex-snapshot

Kohn-Sham equation for time-dependent ensembles

inferredcites →https://doi.org/10.1103/physreva.32.2010openalex-snapshot

Hellmann-Feynman, virial, and scaling requisites for the exact universal density functionals. Shape of the correlation potential and diamagnetic susceptibility for atoms

inferredcites →https://doi.org/10.1103/physreva.32.720openalex-snapshot

Rigorous formulation of Slater’s transition-state theory for excited states

inferredcites →https://doi.org/10.1103/physreva.35.2440openalex-snapshot

Nonlinear response of closed-shell atoms in the density-functional formalism

inferredcites →https://doi.org/10.1103/physreva.35.445openalex-snapshot

Multiphoton ionization of hydrogen: A time-dependent theory

inferredcites →https://doi.org/10.1103/physreva.35.4796openalex-snapshot

Frequency-dependentv-representability in density-functional theory

inferredcites →https://doi.org/10.1103/physreva.36.2726openalex-snapshot

Time-dependent Hartree-Fock theory of multiphoton ionization: Helium

inferredcites →https://doi.org/10.1103/physreva.36.4492openalex-snapshot

Velocity form of the Kohn-Sham frequency-dependent polarizability equations

inferredcites →https://doi.org/10.1103/physreva.37.2805openalex-snapshot

Rayleigh-Ritz variational principle for ensembles of fractionally occupied states

inferredcites →https://doi.org/10.1103/physreva.37.2809openalex-snapshot

Density-functional theory for ensembles of fractionally occupied states. I. Basic formalism

inferredcites →https://doi.org/10.1103/physreva.37.2821openalex-snapshot

Density-functional theory for ensembles of fractionally occupied states. II. Application to the He atom

inferredcites →https://doi.org/10.1103/physreva.38.5512openalex-snapshot

Dynamic linear response of many-electron systems: An integral formulation of density-functional theory

inferredcites →https://doi.org/10.1103/physreva.38.778openalex-snapshot

Time-dependent theory of multiphoton ionization of xenon

inferredcites →https://doi.org/10.1103/physreva.41.78openalex-snapshot

Exchange potentials in density-functional theory

inferredcites →https://doi.org/10.1103/physreva.42.4388openalex-snapshot

Parameter-free exchange potential for excitation in the density-functional theory: Application to excitation energies within the fractional-occupation approach

inferredcites →https://doi.org/10.1103/physreva.44.6334openalex-snapshot

Theory of ab initio molecular-dynamics calculations

inferredcites →https://doi.org/10.1103/physreva.44.r6994openalex-snapshot

Nonperturbative time-dependent theory of helium in a strong laser field

inferredcites →https://doi.org/10.1103/physreva.45.101openalex-snapshot

Construction and application of an accurate local spin-polarized Kohn-Sham potential with integer discontinuity: Exchange-only theory

inferredcites →https://doi.org/10.1103/physreva.45.1509openalex-snapshot

Requirements for correlation energy density functionals from coordinate transformations

inferredcites →https://doi.org/10.1103/physreva.46.5453openalex-snapshot

Systematic approximations to the optimized effective potential: Application to orbital-density-functional theory

inferredcites →https://doi.org/10.1103/physreva.47.165openalex-snapshot

Self-consistent calculations of atomic properties using self-interaction-free exchange-only Kohn-Sham potentials

inferredcites →https://doi.org/10.1103/physreva.47.2800openalex-snapshot

Accurate optimized-potential-model solutions for spherical spin-polarized atoms: Evidence for limitations of the exchange-only local spin-density and generalized-gradient approximations

inferredcites →https://doi.org/10.1103/physreva.49.3074openalex-snapshot

Relativistic density-functional theory for ensembles of excited states

inferredcites →https://doi.org/10.1103/physreva.50.3759openalex-snapshot

Time-dependent functional theory of coupled electron and electromagnetic fields in condensed-matter systems

inferredcites →https://doi.org/10.1103/physreva.51.1883openalex-snapshot

Nonequilibrium time-dependent functional theory for coupled interacting fields

inferredcites →https://doi.org/10.1103/physreva.51.r3414openalex-snapshot

Polarization-dependent high-order two-color mixing

inferredcites →https://doi.org/10.1103/physreva.52.r2527openalex-snapshot

High-intensity two-color interactions in the tunneling and stabilization regimes

inferredcites →https://doi.org/10.1103/physreva.52.r4313openalex-snapshot

Excitation energies from density-functional orbital energies

inferredcites →https://doi.org/10.1103/physreva.53.r5openalex-snapshot

Scaling and virial theorems in current-density-functional theory

inferredcites →https://doi.org/10.1103/physreva.6.709openalex-snapshot

Semiclassical Theory of Inelastic Collisions. I. Classical Picture and Semiclassical Formulation

inferredcites →https://doi.org/10.1103/physrevb.10.3052openalex-snapshot

Dielectric function of the uniform electron gas for large frequencies or wave vectors

inferredcites →https://doi.org/10.1103/physrevb.11.3669openalex-snapshot

Correlation energy and van der Waals interaction of coupled metal films

inferredcites →https://doi.org/10.1103/physrevb.13.2270openalex-snapshot

Van der Waals interaction between an atom and a solid surface

inferredcites →https://doi.org/10.1103/physrevb.13.4274openalex-snapshot

Exchange and correlation in atoms, molecules, and solids by the spin-density-functional formalism

inferredcites →https://doi.org/10.1103/physrevb.18.3126openalex-snapshot

Ground state of the fermion one-component plasma: A Monte Carlo study in two and three dimensions

inferredcites →https://doi.org/10.1103/physrevb.23.5048openalex-snapshot

Self-interaction correction to density-functional approximations for many-electron systems

inferredcites →https://doi.org/10.1103/physrevb.24.4121openalex-snapshot

Resonant two-electron excitation in copper

inferredcites →https://doi.org/10.1103/physrevb.28.5992openalex-snapshot

Self-interaction correction for density-functional theory of electronic energy bands of solids

inferredcites →https://doi.org/10.1103/physrevb.30.5530openalex-snapshot

Towards a Kohn-Sham potential via the optimized effective-potential method

inferredcites →https://doi.org/10.1103/physrevb.31.3486openalex-snapshot

Electronic polarizability of small metal spheres

inferredcites →https://doi.org/10.1103/physrevb.31.6360openalex-snapshot

Size-dependent photoabsorption and photoemission of small metal particles

inferredcites →https://doi.org/10.1103/physrevb.32.1961openalex-snapshot

Collective multipole excitations in small metal particles: Critical angular momentum lcr for the existence of collective surface modes

inferredcites →https://doi.org/10.1103/physrevb.32.6255openalex-snapshot

Violation of sum rules by random-phase-approximation surface response calculations based on a density-functional ground-state description

inferredcites →https://doi.org/10.1103/physrevb.34.4989openalex-snapshot

Dynamical local-field factor in the response function of an electron gas

inferredcites →https://doi.org/10.1103/physrevb.35.3003openalex-snapshot

Correlation effects on the third-frequency-moment sum rule of electron liquids

inferredcites →https://doi.org/10.1103/physrevb.36.4422openalex-snapshot

Local-density-functional calculation of electrodynamic surface response

inferredcites →https://doi.org/10.1103/physrevb.36.7378openalex-snapshot

Dynamical screening at simple-metal surfaces

inferredcites →https://doi.org/10.1103/physrevb.37.10020openalex-snapshot

Density-functional theory for the dynamical response of molecules adsorbed on metal surfaces

inferredcites →https://doi.org/10.1103/physrevb.37.10685openalex-snapshot

Current- and spin-density-functional theory for inhomogeneous electronic systems in strong magnetic fields

inferredcites →https://doi.org/10.1103/physrevb.37.6711openalex-snapshot

Nonlocal corrections to Fresnel optics: Model calculations from first principles for flat jellium

inferredcites →https://doi.org/10.1103/physrevb.39.13120openalex-snapshot

Density-functional approach to nonlinear-response coefficients of solids

inferredcites →https://doi.org/10.1103/physrevb.4.3455openalex-snapshot

High-Frequency Damping in a Degenerate Electron Gas

inferredcites →https://doi.org/10.1103/physrevb.40.10647openalex-snapshot

Optical and magneto-optical absorption in parabolic quantum wells

inferredcites →https://doi.org/10.1103/physrevb.40.158openalex-snapshot

High-frequency damping of collective excitations in fermion systems. I. Plasmon damping and frequency-dependent local-field factor in a two-dimensional electron gas

inferredcites →https://doi.org/10.1103/physrevb.43.1322openalex-snapshot

Collective excitations in open-shell metal clusters: The time-dependent local-density approximation applied to the self-consistent spheroidal jellium particle

inferredcites →https://doi.org/10.1103/physrevb.43.1707openalex-snapshot

Magneto-optical absorption by electrons in the presence of parabolic confinement potentials

inferredcites →https://doi.org/10.1103/physrevb.44.10437openalex-snapshot

Band-structure calculations of noble-gas and alkali halide solids using accurate Kohn-Sham potentials with self-interaction correction

inferredcites →https://doi.org/10.1103/physrevb.44.4032openalex-snapshot

Fluctuation attraction in condensed matter: A nonlocal functional approach

inferredcites →https://doi.org/10.1103/physrevb.46.12943openalex-snapshot

X-ray-scattering determination of the dynamic structure factor of Al metal

inferredcites →https://doi.org/10.1103/physrevb.46.12990openalex-snapshot

Ab initiosimulations of sodium using time-dependent density-functional theory

inferredcites →https://doi.org/10.1103/physrevb.46.4891openalex-snapshot

Influence of nonlocal exchange-correlation effects on the response properties of simple metal clusters

inferredcites →https://doi.org/10.1103/physrevb.46.6671openalex-snapshot

Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation

inferredcites →https://doi.org/10.1103/physrevb.47.12426openalex-snapshot

Dynamic structure of electrons in Al metal studied by inelastic x-ray scattering

inferredcites →https://doi.org/10.1103/physrevb.47.6667openalex-snapshot

Photoabsorption cross section of negatively charged alkali-metal clusters

inferredcites →https://doi.org/10.1103/physrevb.48.4978.2openalex-snapshot

Erratum: Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation

inferredcites →https://doi.org/10.1103/physrevb.49.13744openalex-snapshot

Self-consistent Floquet states for periodically driven quantum wells

inferredcites →https://doi.org/10.1103/physrevb.49.14700openalex-snapshot

Excitation modes of neutral jellium slabs

inferredcites →https://doi.org/10.1103/physrevb.49.8147openalex-snapshot

Thomas–Fermi–Dirac–von Weizsäcker hydrodynamics in parabolic wells

inferredcites →https://doi.org/10.1103/physrevb.50.5651openalex-snapshot

Adsorbate-induced changes of linear and nonlinear electronic-response properties and second-harmonic generation at simple metal surfaces

inferredcites →https://doi.org/10.1103/physrevb.52.11721openalex-snapshot

Dynamic and static structure factor of electrons in Si: Inelastic x-ray scattering results

inferredcites →https://doi.org/10.1103/physrevb.52.6769openalex-snapshot

Time-dependent functional theory for superconductors

inferredcites →https://doi.org/10.1103/physrevb.52.8028openalex-snapshot

Optical sum rules for inhomogeneous electron systems

inferredcites →https://doi.org/10.1103/physrevb.7.3541openalex-snapshot

Theory of Metal Surfaces: Induced Surface Charge and Image Potential

inferredcites →https://doi.org/10.1103/physrevd.24.680openalex-snapshot

Unified approach to the study of light and heavy mesons in the framework of the vacuum-polarization-corrected potential model

inferredcites →https://doi.org/10.1103/physrevlett.45.204openalex-snapshot

Resonant Photoemission in Barium and Cerium

inferredcites →https://doi.org/10.1103/physrevlett.50.2074openalex-snapshot

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inferred← citeshttps://doi.org/10.1007/s10895-009-0531-6openalex-snapshot

Photophysics of 2-(4′-N,N-Dimethylaminophenyl)imidazo[4,5-b]pyridine in Micelles: Selective Dual Fluorescence in Sodium dodecylsulphate and Triton X-100

inferred← citeshttps://doi.org/10.1007/s10910-025-01768-zopenalex-snapshot

Quantum density principle governs DNA mutation fundamentals

inferred← citeshttps://doi.org/10.1007/s10948-005-0081-3openalex-snapshot

Excitonic Collective Mode and Negative Compressibility in Electron Liquids

inferred← citeshttps://doi.org/10.1007/s11051-018-4404-2openalex-snapshot

The geometric and spectroscopic features of (CuSe)n = 2–8 binary nanoclusters: a theoretical study

inferred← citeshttps://doi.org/10.1007/s11164-015-2303-zopenalex-snapshot

Design of (2Z)-2-cyano-2-[2-[(E)-2-[5-[(E)-2-(4-dimethylaminophenyl)vinyl]-2-thienyl]vinyl]pyran-4-ylidene]acetic acid derivatives as D-π-A dye sensitizers in molecular photovoltaics: a density functional theory approach

inferred← citeshttps://doi.org/10.1007/s11356-020-07806-4openalex-snapshot

Mechanism and kinetics of diuron oxidation by hydroxyl radical addition reaction

inferred← citeshttps://doi.org/10.1007/s43630-024-00554-1openalex-snapshot

Primary photophysical and photochemical processes for cerium ammonium nitrate (CAN) in acetonitrile

inferred← citeshttps://doi.org/10.1016/b978-0-08-097774-4.00917-7openalex-snapshot

Calculating Electronic Optical Activity of Coordination Compounds

inferred← citeshttps://doi.org/10.1016/b978-0-12-374396-1.00027-1openalex-snapshot

Quantum Dots: Theory

inferred← citeshttps://doi.org/10.1016/b978-0-12-374920-8.00913-9openalex-snapshot

9.10 MNDO-PSDCI and the Analysis of the Photophysical Properties of Visual Chromophores and Retinal Proteins

inferred← citeshttps://doi.org/10.1016/b978-0-12-408099-7.00003-9openalex-snapshot

Some Recent Developments in the Simplest-Level Electron Nuclear Dynamics Method

inferred← citeshttps://doi.org/10.1016/b978-0-444-53440-8.00007-0openalex-snapshot

Hydrogen and Hydrogen Clusters Across Disciplines

inferred← citeshttps://doi.org/10.1016/j.aop.2014.12.011openalex-snapshot

A quantum relaxation-time approximation for finite fermion systems

inferred← citeshttps://doi.org/10.1016/j.aop.2016.07.008openalex-snapshot

Stochastic TDHF in an exactly solvable model

inferred← citeshttps://doi.org/10.1016/j.apsusc.2004.09.139openalex-snapshot

Theoretical study on the electronic and molecular properties of ground and excited states of ethylenedioxythiophene and styrenesulphonic acid

inferred← citeshttps://doi.org/10.1016/j.aquatox.2020.105417openalex-snapshot

Photolysis and photo-induced toxicity of pyraclostrobin to Vibrio fischeri: Pathway and toxic mechanism

inferred← citeshttps://doi.org/10.1016/j.bioorg.2020.104600openalex-snapshot

Structurally various sorbicillinoids from the deep-sea sediment derived fungus Penicillium sp. SCSIO06871

inferred← citeshttps://doi.org/10.1016/j.bioorg.2022.105603openalex-snapshot

Tamoxifen charge transfer complexes with 2,3-dichloro-5,6-dicyano-1,4-benzoquinone and 7,7,8,8-tetracyanoquinodimethan: Synthesis, spectroscopic characterization and theoretical study

inferred← citeshttps://doi.org/10.1016/j.cclet.2016.07.017openalex-snapshot

Theoretical predication for transition energies of thermally activated delayed fluorescence molecules

inferred← citeshttps://doi.org/10.1016/j.cclet.2020.03.019openalex-snapshot

A review of linear carbon chains

inferred← citeshttps://doi.org/10.1016/j.ccr.2006.05.021openalex-snapshot

Modeling of charge-transfer transitions and excited states in d6 transition metal complexes by DFT techniques

inferred← citeshttps://doi.org/10.1016/j.chemosphere.2021.130401openalex-snapshot

Aqueous picloram degradation by hydroxyl radicals: Unveiling mechanism, kinetics, and ecotoxicity through experimental and theoretical approaches

inferred← citeshttps://doi.org/10.1016/j.chemosphere.2021.132303openalex-snapshot

Comparative analysis on the photolysis kinetics of four neonicotinoid pesticides and their photo-induced toxicity to Vibrio Fischeri: Pathway and toxic mechanism

inferred← citeshttps://doi.org/10.1016/j.chemosphere.2023.138952openalex-snapshot

Direct UV photodegradation of nalidixic acid in aqueous solutions: A mechanistic study

inferred← citeshttps://doi.org/10.1016/j.chemphys.2004.03.005openalex-snapshot

Spectroscopy and photophysics of mono methyl-substituted alloxazines

inferred← citeshttps://doi.org/10.1016/j.chemphys.2004.06.050openalex-snapshot

Calculation of 0–0 excitation energies of organic molecules by CIS(D) quantum chemical methods

inferred← citeshttps://doi.org/10.1016/j.chemphys.2005.03.005openalex-snapshot

Spectroscopy and photophysics of flavin related compounds: Riboflavin and iso-(6,7)-riboflavin

inferred← citeshttps://doi.org/10.1016/j.chemphys.2008.01.010openalex-snapshot

Dynamical variational approach to non-adiabatic electronic structure

inferred← citeshttps://doi.org/10.1016/j.chemphys.2009.05.011openalex-snapshot

Electronic structure and spectral properties of selected trimethyl-alloxazines: Combined experimental and DFT study

inferred← citeshttps://doi.org/10.1016/j.chemphys.2011.04.014openalex-snapshot

Optimization schemes for selective molecular cleavage with tailored ultrashort laser pulses

inferred← citeshttps://doi.org/10.1016/j.chemphys.2011.05.020openalex-snapshot

Accurate singlet and triplet excitation energies using the Localized Hartree–Fock Kohn–Sham potential

inferred← citeshttps://doi.org/10.1016/j.chemphys.2012.03.024openalex-snapshot

Wavelet-based linear-response time-dependent density-functional theory

inferred← citeshttps://doi.org/10.1016/j.cocom.2015.02.001openalex-snapshot

A DFT study of charge-transfer and opto-electronic properties of some new materials involving carbazole units

inferred← citeshttps://doi.org/10.1016/j.commatsci.2013.09.023openalex-snapshot

First-principles study on electronic and optical properties of transparent conducting oxide CuBO2

inferred← citeshttps://doi.org/10.1016/j.compbiolchem.2019.01.013openalex-snapshot

Synthesis, computational quantum chemical study, in silico ADMET and molecular docking analysis, in vitro biological evaluation of a novel sulfur heterocyclic thiophene derivative containing 1,2,3-triazole and pyridine moieties as a potential human topoisomerase IIα inhibiting anticancer agent

inferred← citeshttps://doi.org/10.1016/j.comptc.2010.10.009openalex-snapshot

TDDFT study on the second-order nonlinear optical properties of a series of mono- and di-nuclear [60]fullerene complexes

inferred← citeshttps://doi.org/10.1016/j.comptc.2013.03.028openalex-snapshot

TD-DFT study on the charge-transfer excitations of anions possessing double or triple bonds

inferred← citeshttps://doi.org/10.1016/j.comptc.2014.02.023openalex-snapshot

A simplified time-dependent density functional theory approach for electronic ultraviolet and circular dichroism spectra of very large molecules

inferred← citeshttps://doi.org/10.1016/j.comptc.2016.07.004openalex-snapshot

Ground and excited states of neutral and cationic thieno[3,2-b]thiophene: A DFT study

inferred← citeshttps://doi.org/10.1016/j.comptc.2018.01.003openalex-snapshot

Benchmarking study on time-dependent density functional theory calculations of electronic circular dichroism for gas-phase molecules

inferred← citeshttps://doi.org/10.1016/j.cpc.2015.05.021openalex-snapshot

turboEELS—A code for the simulation of the electron energy loss and inelastic X-ray scattering spectra using the Liouville–Lanczos approach to time-dependent density-functional perturbation theory

inferred← citeshttps://doi.org/10.1016/j.cplett.2005.08.092openalex-snapshot

Time dependent DFT study of the electronic transition energies of RuO4 and OsO4

inferred← citeshttps://doi.org/10.1016/j.cplett.2006.03.006openalex-snapshot

Cavity ring-down spectroscopy of jet-cooled 1-pyrenecarboxyaldehyde (C17H10O) and 1-methylpyrene (C17H12) cations

inferred← citeshttps://doi.org/10.1016/j.cplett.2007.07.027openalex-snapshot

Spectroscopic and theoretical studies on the photophysical properties of dichlorotriazine derivatives

inferred← citeshttps://doi.org/10.1016/j.cplett.2015.03.029openalex-snapshot

Theoretical study of tautomeric equilibria of 2,6-diamino-8-azapurine and 8-aza-iso-Guanine

inferred← citeshttps://doi.org/10.1016/j.cplett.2020.137516openalex-snapshot

Revisiting the π → π* transition of the nitrite ion at the air/water interface: A combined experimental and theoretical study

inferred← citeshttps://doi.org/10.1016/j.dyepig.2009.07.014openalex-snapshot

Novel, soluble diphenyl-diketo-pyrrolopyrroles: Experimental and theoretical study

inferred← citeshttps://doi.org/10.1016/j.dyepig.2020.108677openalex-snapshot

Cu2+/ATP reversible ratiometric fluorescent probe through strip, hydrogel, and nanofiber, and its application in living cells and edaphic ecological safety assessment

inferred← citeshttps://doi.org/10.1016/j.fitote.2017.06.013openalex-snapshot

Vaccinols J–S, ten new salicyloid derivatives from the marine mangrove-derived endophytic fungus Pestalotiopsis vaccinii

inferred← citeshttps://doi.org/10.1016/j.ica.2014.10.014openalex-snapshot

Synthesis, crystal structures and luminescent properties of the copper(I) pyrazolonate complexes

inferred← citeshttps://doi.org/10.1016/j.jmgm.2018.12.001openalex-snapshot

Nucleotide conjugated (ZnO)3 cluster: Interaction and optical characteristics using TDDFT

inferred← citeshttps://doi.org/10.1016/j.jmgm.2019.06.016openalex-snapshot

Thermodynamic of solvation, solute – Solvent electron transfer and ionization potential of BSCAPE molecule and its UV–vis spectra in aqueous solution

inferred← citeshttps://doi.org/10.1016/j.jms.2016.06.015openalex-snapshot

Predicting accurate fluorescent spectra for high molecular weight polycyclic aromatic hydrocarbons using density functional theory

inferred← citeshttps://doi.org/10.1016/j.jorganchem.2004.09.013openalex-snapshot

A theoretical investigation of the photo-induced intramolecular charge transfer excitation of cuprous (I) bis-phenanthroline by density functional theory

inferred← citeshttps://doi.org/10.1016/j.jorganchem.2006.06.039openalex-snapshot

Molecular and electronic structure of (η5-pentaalkyl-2,3-dihydro-1,3-diborolyl)(η5-pentamethylcyclopentadienyl)metal complexes, M = Fe, Ru

inferred← citeshttps://doi.org/10.1016/j.jpcs.2022.110933openalex-snapshot

A new approach to chromeno[4,3-b]pyridine: Synthesis, X-ray, spectral investigations, hirshfeld surface analysis, and computational studies

inferred← citeshttps://doi.org/10.1016/j.jphotochem.2004.08.022openalex-snapshot

Spectroscopy and photophysics of flavin-related compounds: 3-ethyl-lumiflavin

inferred← citeshttps://doi.org/10.1016/j.jphotochem.2006.07.005openalex-snapshot

New photochemically stable riboflavin analogue—3-Methyl-riboflavin tetraacetate

inferred← citeshttps://doi.org/10.1016/j.jphotochem.2006.10.004openalex-snapshot

Investigation of the photo-dissociation reactions for alkyl nitrite by quantum chemical molecular dynamics program “Colors-Excite”

inferred← citeshttps://doi.org/10.1016/j.jphotochem.2007.02.007openalex-snapshot

Exciting flavins: Absorption spectra and spin–orbit coupling in light–oxygen–voltage (LOV) domains

inferred← citeshttps://doi.org/10.1016/j.jphotochem.2008.07.006openalex-snapshot

Spectroscopy and photophysics of dimethyl-substituted alloxazines

inferred← citeshttps://doi.org/10.1016/j.jphotochem.2010.06.014openalex-snapshot

Theoretical study on photochemical behavior of trans-2-[4′-(dimethylamino)styryl]benzothiazole

inferred← citeshttps://doi.org/10.1016/j.jphotochem.2022.113875openalex-snapshot

A theoretical and experimental analysis of the luminescent properties of Europium(III) complex sensitized by tryptophan

inferred← citeshttps://doi.org/10.1016/j.molstruc.2003.10.028openalex-snapshot

Spectroscopy and photophysics of 9-methylalloxazine. Experimental and theoretical study

inferred← citeshttps://doi.org/10.1016/j.molstruc.2004.04.005openalex-snapshot

Electronic structure of isoalloxazines in their ground and excited states

inferred← citeshttps://doi.org/10.1016/j.molstruc.2004.04.011openalex-snapshot

Spectroscopy and photophysics of 6,7-dimethyl-alloxazine: experimental and theoretical study

inferred← citeshttps://doi.org/10.1016/j.molstruc.2005.09.005openalex-snapshot

Spectroscopy and photophysics of flavin-related compounds: 5-deaza-riboflavin

inferred← citeshttps://doi.org/10.1016/j.molstruc.2019.03.030openalex-snapshot

Quantum-chemical characterization of ion-pairing effect on the linear and third-order nonlinear optical response in cyanine dyes

inferred← citeshttps://doi.org/10.1016/j.molstruc.2020.128180openalex-snapshot

Structural, optical, morphology characterization and DFT studies of nano sized Cu(II) complexes containing schiff base using green synthesis

inferred← citeshttps://doi.org/10.1016/j.molstruc.2022.134403openalex-snapshot

Stereochemical inversion of pillar[5]arene. NMR and DFT studies

inferred← citeshttps://doi.org/10.1016/j.mssp.2024.109171openalex-snapshot

Excited-state electronic, optical and magneto-optical properties of ferromagnetic monolayer NiCl2

inferred← citeshttps://doi.org/10.1016/j.nexres.2025.101029openalex-snapshot

Nonlinear optical efficiency and bio-affinity of teneligliptin: Insights from multi-solvated DFT and molecular docking analyses

inferred← citeshttps://doi.org/10.1016/j.nimb.2014.09.035openalex-snapshot

Theoretical study of the channeling effect in the electronic stopping power of silicon carbide nanocrystal for low-energy protons and helium ions

inferred← citeshttps://doi.org/10.1016/j.nimb.2016.12.017openalex-snapshot

Electronic stopping power of slow H+ and He2+ ions in CdTe from first principle

inferred← citeshttps://doi.org/10.1016/j.nimb.2023.165230openalex-snapshot

Electronic stopping in ternary material SiCN: Anomalous behavior of slow channeling helium ions

inferred← citeshttps://doi.org/10.1016/j.orgel.2015.03.037openalex-snapshot

An isomeric strategy for enhancing phosphorescence efficiency of iridium(III) complexes with N-heterocyclic naphthyridine ligands: A theoretical study

inferred← citeshttps://doi.org/10.1016/j.physb.2004.06.005openalex-snapshot

First-principles calculations for structures and absorption optical spectra of sulfur cluster S7

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