Kaveh Haghighi Mood

Kaveh Haghighi Mood

Forschungszentrum Jülich - Jülich / Germany
Natural Sciences / Physics
AD Scientific Index ID: 4564347
Jülich Research Centre
person_outline Kaveh Haghighi Mood's MOST POPULAR ARTICLES
1-) DFT/B3LYP study of the substituent effect on the reaction enthalpies of the individual steps of single electron transfer–proton transfer and sequential proton loss electron …M Najafi, KH Mood, M Zahedi, E KleinComputational and Theoretical Chemistry 969 (1-3), 1-12, 2011442011
2-) DFT/B3LYP study of the substituent effects on OH bond dissociation enthalpies of chroman derivatives in the gas phase and solvent environmentM Najafi, E Nazarparvar, KH Mood, M Zahedi, E KleinComputational and Theoretical Chemistry 965 (1), 114-122, 2011382011
3-) Massive-Parallel Trajectory Calculations version 2.2 (MPTRAC-2.2): Lagrangian transport simulations on Graphics Processing Units (GPUs)L Hoffmann, PF Baumeister, Z Cai, J Clemens, S Grießbach, G Günther, ...Geoscientific Model Development Discussions, 1-51, 202125*2021
4-) Generic expansion of the Jastrow correlation factor in polynomials satisfying symmetry and cusp conditionsA Lüchow, A Sturm, C Schulte, K Haghighi MoodThe Journal of Chemical Physics 142 (8), 2015242015
5-) Full wave function optimization with quantum Monte Carlo and its effect on the dissociation energy of FeSK Haghighi Mood, A LüchowThe Journal of Physical Chemistry A 121 (32), 6165-6171, 2017192017