Jaime M. Martell

发表

DFT study of five naphthalimide derivatives: Structures and redox properties

L. Eriksson, M. M. MacIntyre, Jaime M. Martell, 2010 .

Ab initio Studies of Reactions of Hydroxyl Radicals with Fluorinated Ethanes

Russell J. Boyd, R. J. Boyd, Jaime M. Martell, 1995 .

Assessment of Basis Set and Functional Dependencies in Density Functional Theory: Studies of Atomization and Reaction Energies

Leif A. Eriksson, John D. Goddard, Jaime M. Martell, 1997 .

Hydrogen Abstraction from Fluorinated Ethyl Methyl Ether Systems by OH Radicals

Curtis White, Jaime M. Martell, 2016 .

Effects of electron correlation on the series C2HnF6-n (n = 0-6) : geometries, total energies, and C-C and C-H bond dissociation energies

R. J. Boyd, Jaime M. Martell, Zheng Shi, 1993 .

Topological properties of the electronic structures of the reactants, transition states, and products of the reactions of the hydroxyl radical with the series C2HnF6−n, n = 1–6

R. J. Boyd, Jaime M. Martell, J. Tee, 1996 .

An ab initio study of the series of fluorinated ethanes C2HnF6-n (n = 0-6): geometries, total energies, and carbon-carbon bond dissociation energies

R. J. Boyd, Jaime M. Martell, 1992 .

Theoretical study of pyridoxine (vitamin B6) photolysis.

Leif A Eriksson, L. Eriksson, Qi Xu, 2011, The journal of physical chemistry. A.

DFT and experimental study of the structure and vibrational spectra of 2-(benzylthio)-N-{pyridinylmethylidene}anilines

R. McDonald, Jaime M. Martell, Alberto Acosta-Ramírez, 2013 .

Hyperfine Structures of the Series C2HnF5-n, n = 0-5: A Density Functional Theory Study.

R. J. Boyd, L. Eriksson, Jaime M. Martell, 1995 .

Ab initio studies of fluorinated ethanes: Electronic and energetic properties and reactions with hydroxyl radicals.

Jaime M. Martell, 1995 .

Synthesis and structure of mixed chloride–tetrachloroaluminate salts

M. Zaworotko, Jaime M. Martell, 1991 .

MOLECULAR DECOMPOSITIONS OF ACETALDEHYDE AND FORMAMIDE : THEORETICAL STUDIES USING HARTREE-FOCK, MOLLER-PLESSET AND DENSITY FUNCTIONAL THEORIES

Jaime M. Martell, Hengtai Yu, J. D. Goddard, 1997 .

Comparisons between Density Functional Theory and Conventional ab Initio Methods for 1,2-Elimination of HF from 1,1,1-Trifluoroethane: Test Case Study for HF Elimination from Fluoroalkanes†

B. E. Holmes, Jaime M. Martell, Paul T. Beaton, 2002 .