J. M. Martin

发表

Theoretical study of the proton affinities of 2‐, 3‐, and 4‐monosubstituted phenolate ions in the gas phase by means of MINDO/3, MNDO, and AM1

J. Mullens, J. Yperman, Jan M. L. Martin, 1990 .

Computational study of a new heck reaction mechanism catalyzed by palladium(II/IV) species.

Jan M. L. Martin, J. M. Martin, A. Sundermann, 2001, Chemistry.

Application of Wiberg indices to geometry optimization. CC distances

J. Tortajada, J. M. Martin, Manuel Hernández Fernández, 1988 .

A fully ab initio potential curve of near-spectroscopic quality for OH- ion: importance of connected quadruple excitations and scalar relativistic effects.

J. M. Martin, 2000, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Comparison of steric and electronic requirements for C-C and C-H bond activation. Chelating vs nonchelating case.

H. Rozenberg, D. Milstein, B. Rybtchinski, 2001, Journal of the American Chemical Society.

A critical comparison of MINDO/3, MNDO, AM1, and PM3 for a model problem: Carbon clusters C2‐C10. An ad hoc reparametrization of MNDO well suited for the accurate prediction of their spectroscopic constants

R. Gijbels, Jan M. L. Martin, J. François, 1990 .

Theoretical study of the proton affinities of 2‐, 3‐, and 4‐monosubstituted pyridines in the gas phase by means of MINDO/3, MNDO, and AM1

R. Voets, J. Mullens, J. Yperman, 1989 .

Ab initio study of the proton affinity of a number of ortho‐substituted pyridines

R. Gijbels, J. François, J. M. Martin, 1989 .

Combined bond-polarization basis sets for accurate determination of dissociation energies

R. Gijbels, J. François, J. M. Martin, 1989 .

Combined bond polarization function basis sets for accurate ab initio calculation of the dissociation energies of AHn molecules (A=LI to F)

R. Gijbels, J. François, J. M. Martin, 1989 .

Combined bond‐polarization basis sets for accurate determination of dissociation energies. II. Basis set superposition error as a function of the parent basis set

R. Gijbels, J. François, J. M. Martin, 1989 .

Crystal and phonon structure of ZnSiP2, a II-IV-V2 semiconducting compound

S. A. López-Rivera, J. M. Delgado, J. M. Martin, 2012 .

Fully ab initio atomization energy of benzene via Weizmann-2 theory

J. M. Martin, S. Parthiban, 2001, physics/0105060.

Ab initio spectroscopy and thermochemistry of the BN molecule

R. Gijbels, J. François, J. M. Martin, 1991 .

Crystal structures of bis-(N-methyl-N-phenyldithiocarbamato)-nickel-(II) and -copper(II)

P. Newman, B. W. Robinson, J. M. Martin, 1972 .