José Rachid Mohallem

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Alexander AlijahUniversity of ReimsVerified email at univ-reims.fr
COLM WHELANEminent Professor of PhysicsVerified email at odu.edu
Ludwik AdamowiczNicolaus Copernicus UniversityVerified email at email.arizona.edu
Helio ChachamProfessor of Physics, Universidade Federal de Minas GeraisVerified email at fisica.ufmg.br
Reinaldo Oliveira ViannaAssociate Professor, Physics Department, UFMGVerified email at fisica.ufmg.br
A D QuintaoProfessor Universitário, Centro Universitário Fundação Santo AndreVerified email at fsa.br
Monika Stankedr hab., Uniwersytet Mikołaja KopernikaVerified email at fizyka.umk.pl
ALFREDO MAYALL SIMASUniversidade Federal de PernambucoVerified email at ufpe.br
Polyansky olleading research fellow IAP,Russia, Nizhny Novgorod, Honorary Professor, UCL, London UKVerified email at ucl.ac.uk
Jonathan TennysonUniversity College LondonVerified email at ucl.ac.uk
Michele PavanelloProfessor, Rutgers University-NewarkVerified email at rutgers.edu
Rogerio CustodioProfessor of Physical Chemistry, State University of CampinasVerified email at unicamp.br
Felipe ArretchePhysics Professor, Federal University of Santa CatarinaVerified email at ufsc.br
Vinícius Cândido MotaProfessor of Physics, Universidade Federal do Espírito SantoVerified email at ufes.br
William A. Lester Jr.Professor of Chemistry, University of California, BerkeleyVerified email at cchem.berkeley.edu
Thomas HeineProfessor of Theoretical ChemistryVerified email at tu-dresden.de
Joao Pedro BragaProfessor de Química, UFMGVerified email at ufmg.br
Pedro Jorge dos Santos Branco Carid...Universidade de CoimbraVerified email at uc.pt
A. J. C. VarandasUniversidade de CoimbraVerified email at uc.pt
Keith A. JonesCroplife InternationalVerified email at sustagri.com

José Rachid Mohallem

Professor of Physics, Universidade Federal de Minas Gerais

Verified email at fisica.ufmg.br

Atomic and Molecular Physics


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A Griffin–Hill–Wheeler version of the Hartree–Fock equations JR Mohallem, RM Dreizler, M Trsic International Journal of Quantum Chemistry 30 (S20), 45-55, 1986	184	1986
A further study on the discretisation of the Griffin-Hill-Wheeler equation JR Mohallem Zeitschrift für Physik D Atoms, Molecules and Clusters 3, 339-344, 1986	122	1986
A universal Gaussian basis set for atoms Li through Ne based on a generator coordinate version of the Hartree–Fock equations JR Mohallem, M Trsic The Journal of chemical physics 86 (9), 5043-5044, 1987	73	1987
Differential and total cross sections for antiproton-impact ionization of atomic hydrogen and helium M McGovern, D Assafrão, JR Mohallem, CT Whelan, HRJ Walters Physical Review A 79 (4), 042707, 2009	67	2009
Universal gaussian and Slater-type basis sets for atoms He to Ar based on an integral version of the Hartree-Fock equations HFM da Costa, M Trsic, JR Mohallem Molecular Physics 62 (1), 91-95, 1987	66	1987
Variational calculations for the bound-unbound transition of the Yukawa potential OA Gomes, H Chacham, JR Mohallem Physical Review A 50 (1), 228, 1994	63	1994
Coincidence studies of He ionized by , , and M McGovern, D Assafrao, JR Mohallem, CT Whelan, HRJ Walters Physical Review A 81 (4), 042704, 2010	60	2010
Vibrationally and rotationally nonadiabatic calculations on using coordinate-dependent vibrational and rotational masses LG Diniz, JR Mohallem, A Alijah, M Pavanello, L Adamowicz, ... Physical Review A 88 (3), 032506, 2013	51	2013
Interdisciplinary applications of Pauling's metallic orbital and unsynchronized resonance to problems of modern physical chemistry: conductivity, magnetism, molecular stability … AC Pavao, CA Taft, TCF Guimaraes, MBC Leao, JR Mohallem, WA Lester The Journal of Physical Chemistry A 105 (1), 5-11, 2001	38	2001
A new algorithm to handle finite nuclear mass effects in electronic calculations: The ISOTOPE program CP Gonçalves, JR Mohallem Journal of computational chemistry 25 (14), 1736-1739, 2004	35	2004
Evidences of molecular structure beyond the Born–Oppenheimer approximation: the model hamiltonian JR Mohallem Journal of Molecular Structure: THEOCHEM 709 (1-3), 11-13, 2004	33	2004
Molecular structure and Bader's theory JR Mohallem Theoretical Chemistry Accounts 107, 372-374, 2002	31	2002
Pseudostate methods and differential cross sections for antiproton ionization of atomic hydrogen and helium M McGovern, D Assafrão, JR Mohallem, CT Whelan, HRJ Walters Physical Review A 81 (3), 032708, 2010	30	2010
Pauling’s resonating valence bond theory of metals: some studies on lithium clusters JR Mohallem, RO Vianna, AD Quintão, AC Pavão, R McWeeny Zeitschrift Für Physik D Atoms, Molecules and Clusters 42, 135-143, 1997	29	1997
Separation of motions of atomic cores and valence electrons in molecules JR Mohallem, LG Diniz, AS Dutra Chemical Physics Letters 501 (4-6), 575-579, 2011	27	2011
A molecular model for positron complexes: long-range effects on 2γ pair-annihilation rates JR Mohallem, F Rolim, CP Gonçalves Journal of Physics B: Atomic, Molecular and Optical Physics 37 (5), 1045, 2004	27	2004
Self-consistent-field–Hartree–Fock method with finite nuclear mass corrections CP Gonçalves, JR Mohallem Theoretical Chemistry Accounts 110, 367-370, 2003	27	2003
Adiabatic corrections to density functional theory energies and wave functions JR Mohallem, T de O. Coura, LG Diniz, G De Castro, D Assafrão, T Heine The Journal of Physical Chemistry A 112 (38), 8896-8901, 2008	26	2008
The generator coordinate Hartree-Fock method for molecular systems. Formalism and first applications to H2, LiH and Li2 HFM Da Costa, ABF Da Silva, JR Mohallem, AM Simas, M Trsic Chemical physics 154 (3), 379-384, 1991	26	1991
Unified description of chemical bonding in H2 isotopomers, including Ps2, μ2 and bi-excitons F Rolim, JP Braga, JR Mohallem Chemical Physics Letters 332 (1-2), 139-144, 2000	24	2000

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