Search Result "non-adiabatic chemistry"


Computational Studies of Photodissociation, Photoinduced Isomerization, and Stereochemistry of Coordination Complexes

Journal: Current Inorganic Chemistry (Discontinued)
Volume: 3 Issue: 3 Year: 2013 Page: 196-212
Author(s): Justyna M. Zurek,Martin J. Paterson

Unexpected Gas-Phase Ion Chemistry Results Unraveled by Computational Chemistry

Journal: Current Organic Chemistry
Volume: 14 Issue: 1 Year: 2010 Page: 1600-1611
Author(s): Jose A. Gamez, Ines Corral, Otilia Mo, Manuel Yanez

Research Article

Theoretical Values, Percentage Deviations and Calculated Values by Polynomials Equation’s of The liquid Mixture with Equimolar mixture of Ethanol and Formamide.

Journal: Current Physical Chemistry
Volume: 10 Issue: 0 Year: 2020 Page: 1-14
Author(s): Ritesh Yadav,Vivekanand Mishra,Bhavya Salvi,Bhavi Patel

Review Article

Combined Quantum and Molecular Mechanics (QM/MM) Approaches to Simulate Ultrafast Photodynamics in Biological Systems

Journal: Current Organic Chemistry
Volume: 21 Issue: 7 Year: 2017 Page: 586-601
Author(s): Oliver Weingart

Quantum Chemistry in Drug Design: Density Function Theory (DFT) and Other Quantum Mechanics (QM)-related Approaches

Ebook: Applied Computer-Aided Drug Design: Models and Methods

Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815179934123010010

Effects of Preheating Temperature and Fuel-Air Equivalence Ratio on Pollution Control in Hydro Carbon Combustion

Ebook: Mechanical Engineering Technologies and Applications

Volume: 2 Year: 2023
Author(s):
Doi: 10.2174/9789815124125123020008

Viscous Fingering Phenomena with Chemical Reactions

Journal: Current Physical Chemistry
Volume: 5 Issue: 1 Year: 2015 Page: 52-63
Author(s): Yuichiro Nagatsu

Sonochemistry of Homogeneous Ionic Reactions

Journal: Mini-Reviews in Organic Chemistry
Volume: 7 Issue: 3 Year: 2010 Page: 204-211
Author(s): A. Tuulmets, G. Cravotto, S. Salmar, J. Jarv

Estimation of Electronic Coupling for Charge Transfer in Bioinorganic Molecules

Journal: Current Inorganic Chemistry (Discontinued)
Volume: 3 Issue: 3 Year: 2013 Page: 260-269
Author(s): Alexander A. Voityuk

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