Optical Properties, Electronic Excitations
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* TDDFT Study of 3 different Dihydroxyanthraquinones

* GW: Ionization Potential and Electron Affinity

* Thermally Activated Delayed Fluorescence (TADF)

* Vibrational progression of an OLED phosphorescent emitter

* Plasmon Enhanced Two Photon Absorption

* UV/Vis spectrum of Ir(ppy)3

* GW-BSE: the singlet-triplet (S_0-T_1) gap of Benzene

* CD and CPL for spin-forbidden electronic transitions

* ROKS-TDA-SOC

* PolTDDFT: damped complex polarizabilities Au_12

* Eu3+ Luminescence properties with Ligand Field DFT

* QM/FQ coupled to MD: UV/Vis absorption in aqueous solution

* Modeling phosphorescent lifetimes of OLED emitters

* TD-CDFT Response Properties For Crystals (OldResponse)

* TD-CDFT Response properties for a 2D periodic system (NewResponse)

* L-Edge X-Ray spectrum NEXAFS

* Core Ionization Potentials (XPS) of thiophene

TDDFT Study of 3 different Dihydroxyanthraquinones[image]

**Keywords:** ADF, UV/Vis, TDDFT, sTDDFT, Canonical Molecular Orbitals
(CMO), Natural Transition Orbitals (NTOs), NBO, solvation

GW: Ionization Potential and Electron Affinity[image]

**Keywords:** ADF, GW, G_0W_0@PBE0, quasi-particles (particles/holes),
Ionization Potentials (IP), Electron Affinities (EA).

Thermally Activated Delayed Fluorescence (TADF)[image]

**Keywords:** ADF, UV/Vis, organic electronics, OLED, Vertical
Absorption, Phosphorescence, intersystem crossings, spin-orbit
coupling (SOC), Marcus Theory

Vibrational progression of an OLED phosphorescent emitter[image]

**Keywords:** ADF, UV/Vis, organic electronics, OLED, Vertical
Absorption, Phosphorescence, Franck-Condon Spectrum

Plasmon Enhanced Two Photon Absorption[image]

**Keywords:** ADF, DIM/QM, PIM, Python scripting (PLAMS)

GW-BSE: the singlet-triplet (S0-T1) gap of Benzene[image]

**Keywords:** ADF, UV/Vis, excitations, GW-BSE, quasi-particles

PolTDDFT: damped complex polarizabilities Au12[image]

**Keywords:** ADF, UV/Vis, excitations, absorption, POLTDDFT

UV/Vis spectrum of Ir(ppy)3[image]

**Keywords:** DFTB, UV/Vis, excitations, TD-DFTB

Eu3+ Luminescence properties with Ligand Field DFT[image]

**Keywords:** ADF, excitations, lanthanides, XANES, luminescence,
inorganic LEDs

QM/FQ coupled to MD: UV/Vis absorption in aqueous solution[image]

**Keywords:** ADF, UV/Vis, excitations, Molecular Dynamics

Modeling phosphorescent lifetimes of OLED emitters[image]

**Keywords:** ADF, OLED, Spin-orbit

TD-CDFT Response Properties For Crystals (OldResponse)[image]

**Keywords:** BAND,  dielectric function, susceptibilities,
polarizability, refractive index, time-dependent current density
function theory

TD-CDFT Response properties for a 2D periodic system
(NewResponse)[image]

**Keywords:** BAND,  dielectric function, susceptibilities,
polarizability, refractive index, time-dependent current density
function theory

L-Edge X-Ray spectrum NEXAFS[image]

**Keywords:** ADF, excitations

Core Ionization Potentials (XPS) of thiophene[image]

**Keywords:** ADF, excitations
