Computational studies of photophysical properties of porphin, tetraphenylporphyrin and tetrabenzoporphyrin

Ab Initio Studies of Triplet-State Properties for Organic Semiconductor Molecules

(2012) Mathias Pabst et al.   Journal of Physical Chemistry C

First-order nonadiabatic couplings from time-dependent hybrid density functional response theory: Consistent formalism, implementation, and performance

(2010) Robert Send et al.   JOURNAL OF CHEMICAL PHYSICS

Impact of triplet absorption and triplet-singlet annihilation on the dynamics of optically pumped organic solid-state lasers

(2010) M. Lehnhardt et al.   PHYSICAL REVIEW B

The polarizability in solution of tetra-phenyl-porphyrin derivatives in their excited electronic states: a PCM/TD-DFT study

(2009) Roberto Improta et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Singlet and Triplet Excited States and Intersystem Crossing in Free-Base Porphyrin: TDDFT and DFT/MRCI Study

(2008) Serhiy Perun et al.   CHEMPHYSCHEM

Calculation of electronic spectra of porphin and its derivatives by a modified INDO/S method

(2008) V. A. Kuzmitsky et al.   Journal of Applied Spectroscopy

Benchmarks for electronically excited states: Time-dependent density functional theory and density functional theory based multireference configuration interaction

(2008) Mario R. Silva-Junior et al.   JOURNAL OF CHEMICAL PHYSICS

Computational studies of semiconductor quantum dots

(2008) Olli Lehtonen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Quantum efficiency roll-off at high brightness in fluorescent and phosphorescent organic light emitting diodes

(2008) N. C. Giebink et al.   PHYSICAL REVIEW B