Results 291 to 300 of about 7,655,786 (300)

The Quantum-Chemical Calculation of NMR Indirect Spin–Spin Coupling Constants

Progress in Nuclear Magnetic Resonance Spectroscopy, 2008
Magdalena Pecul-Kudelska, Trygve Ulf Helgaker, Michał Jaszuński   +2 more
exaly  

Theoretical Consideration of Singlet Open-Shell Character of Polyperiacenes Using Clar's Aromatic Sextet Valence Bond Model and Quantum Chemical Calculations

AIP Conference Proceedings, 2012
Yasukazu Hirao, Takashi Kubo, Edith Botek   +2 more
exaly  

Quantum-chemical calculations

openaire   +1 more source

Exciton Scattering Approach for Branched Conjugated Molecules and Complexes. II. Extraction of the Exciton Scattering Parameters From Quantum-Chemical Calculations

Journal of Chemical Physics, 2008
Sergei Tretiak, Chao Wu, Sergey V Malinin   +2 more
exaly  

Lecture Notes On Quantum Chemical Calculation

2016
openaire   +1 more source

RESEARCH NOTES ON QUANTUM CHEMICAL CALCULATION

2015
openaire   +1 more source

Ab Initio Quantum-Chemical Calculations in Electrochemistry

2004
Marc Koper
exaly  

Lecture Notes On Quantum Chemical Calculation

2018
openaire   +1 more source

Quantum chemical calculations on organic superlattices

1993
G. F. Musso, G. Dellepiane, RUI, MARINA, C. Cuniberti, a. Bolognesi   +4 more
openaire   +1 more source

RECENT ADVANCES IN QUANTUM CHEMICAL CALCULATIONS

openaire   +1 more source