Follow
Michael DMello
Michael DMello
Intel Corporation at Argonne National Labs
Verified email at anl.gov
Title
Cited by
Cited by
Year
Experimental Studies and Theoretical Predictions for the H + D2 → HD + D Reaction
L Schnieder, K Seekamp-Rahn, J Borkowski, E Wrede, KH Welge, FJ Aoiz, ...
Science 269 (5221), 207-210, 1995
1901995
Computer modeling of electrostatic steering and orientational effects in antibody-antigen association
RE Kozack, MJ d'Mello, S Subramaniam
Biophysical journal 68 (3), 807-814, 1995
881995
Quantum reactive scattering via the log derivative version of the Kohn variational principle: General theory for bimolecular chemical reactions
DE Manolopoulos, M D’Mello, RE Wyatt
The Journal of chemical physics 91 (10), 6096-6102, 1989
881989
Quantum dynamics of the H+D2→D+HD reaction: Comparison with experiment
M D’Mello, DE Manolopoulos, RE Wyatt
The Journal of chemical physics 94 (9), 5985-5993, 1991
851991
Translational basis set contraction in variational reactive scattering
DE Manolopoulos, M D’Mello, RE Wyatt
The Journal of chemical physics 93 (1), 403-411, 1990
751990
Quantum mechanical and quasiclassical calculations for the H+D2→HD+D reaction: Reaction probabilities and differential cross sections
FJ Aoiz, L Bañares, MJ D’mello, VJ Herrero, VS Rábanos, L Schnieder, ...
The Journal of chemical physics 101 (7), 5781-5791, 1994
641994
A topological study of the structure of the C76 fullerene
O Ori, M D'Mello
Chemical physics letters 197 (1-2), 49-54, 1992
601992
Experimental and quantum mechanical study of the H+D reaction near 0.5 eV: The assessment of the potential energy surfaces
L Bañares, FJ Aoiz, VJ Herrero, MJ D’Mello, B Niederjohann, ...
The Journal of chemical physics 108 (15), 6160-6169, 1998
591998
Converged variational quantum scattering results for the three dimensional F+ D2 reaction
M D'Mello, DE Manolopoulos, RE Wyatt
Chemical physics letters 168 (2), 113-118, 1990
491990
Converged variational quantum scattering results for the three-dimensional F+ HD reaction
DE Manolopoulos, M D'Mello, RE Wyatt, RB Walker
Chemical physics letters 169 (6), 482-488, 1990
321990
Inclusion of the geometric phase in quantum reactive scattering calculations: A variational formulation
X Wu, RE Wyatt, M D’Mello
The Journal of chemical physics 101 (4), 2953-2967, 1994
301994
An efficient MPI/openMP parallelization of the Hartree-Fock method for the second generation of Intel® Xeon Phi processor
V Mironov, Y Alexeev, K Keipert, M D'mello, A Moskovsky, MS Gordon
Proceedings of the international conference for high performance computing …, 2017
272017
Theory, Experiment, and the H + D2 Reaction
MJ D'Mello, DE Manolopoulos, RE Wyatt
Science 263 (5143), 102-102, 1994
271994
An efficient MPI/OpenMP parallelization of the Hartree–Fock–Roothaan method for the first generation of Intel® Xeon Phi™ processor architecture
V Mironov, A Moskovsky, M D’Mello, Y Alexeev
The International Journal of High Performance Computing Applications 33 (1 …, 2019
212019
Analysis of the structure of the C78 fullerene: A topological approach
O Ori, M D'Mello
Applied Physics A 56 (1), 35-39, 1993
181993
Recursive generation of individual S-matrix elements: Application to the collinear H+ H2 reaction
M D'Mello, C Duneczky, RE Wyatt
Chemical physics letters 148 (2-3), 169-176, 1988
151988
Quantum mechanical rate constants for the D+ H2→ HD+ H reaction on the BKMP2 potential energy surface
L Banares, MJ D'Mello
Chemical physics letters 277 (5-6), 465-472, 1997
141997
V. Sa ez Ra banos and RE Wyatt
L Schnieder, K Seekamp-Rahn, J Borkowski, E Wrede, KH Welge, FJ Aoiz, ...
Science 269, 207, 1995
141995
Quantum functional sensitivity analysis for the collinear H+H2 reaction rate coefficient
J Chang, NJ Brown, M D’Mello, RE Wyatt, H Rabitz
The Journal of chemical physics 96 (5), 3523-3530, 1992
131992
Predicting observables on different potential energy surfaces using feature sensitivity analysis: Application to the collinear H+H2 exchange reaction
J Chang, NJ Brown, M D’Mello, RE Wyatt, H Rabitz
The Journal of chemical physics 97 (9), 6240-6248, 1992
111992
The system can't perform the operation now. Try again later.
Articles 1–20