A. Sevin

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A theoretical ab initio SCF CI investigation of the Na + H2 reaction: The possibility of new photoreactive channels in the 4 eV region

A. Sevin, P. Chaquin, 1985 .

Comparison of the activation of small covalent molecules by transition dimetals and monometals: A theoretical semi-empirical study

A. Sevin, P. Chaquin, H. T. Yu, 1985 .

A theoretical study of the bonding in NO, (NO)2, (NO)2− and (NO)22− using a topological analysis of the electron localization function

H. Chevreau, A. Sevin, F. Fuster, 2004 .

The nature of the chemical bonding in the D3h and C2v isomers of Fe3(CO)12

B. Silvi, H. Chevreau, C. Minot, 2003 .

Theoretical ab initio SCF-CI study of the photochemical behavior of HN3 and related species

B. Bigot, A. Sevin, A. Devaquet, 1980 .

Theoretical exploratory study of the strong conformational and diastereotopic effects found in the vertical anion of α-halogen-substituted open-chain and three-membered ring compounds bearing a heteroatom (N, O, P)

H. Chevreau, A. Sevin, C. Dézarnaud-Dandine, 1998 .

A theoretical study of the formation of stable anion intermediates via electron capture by heterosubstituted three membered ring XCH2CY2 compounds (X = O, S, NH, PH; Y = H, F)

H. Chevreau, A. Sevin, C. Dézarnaud-Dandine, 1996 .

A theoretical study of singlet and triplet phosphinidenes PAX3 (A = C, Si; X = H, F) and their rearrangement to phosphaethenes XPAX2

A. Sevin, P. Chaquin, Amel Gherbi, 1996 .

A theoretical investigation on the electron-acceptor properties of polar CS bonds of CH3−nFnSH (n = 0–3) thiols and CH3−nFnSCH3−nFn (n = 0–3) sulfides

A. Sevin, C. Dézarnaud-Dandine, 1995 .

Theoretical investigation on the acceptor role of σ∗ MOs in three and four-membered ring thio compounds and their open chain analogues. Comparison of ground state, lowest energy triplet state and anion properties

A. Sevin, C. Dézarnaud-Dandine, 1995 .

Bridged versus classical structures in boron-substituted phosphinidenes. A theoretical study of singlet and triplet low energy species

A. Sevin, P. Chaquin, Amel Gherbi, 1994 .

A theoretical investigation of the adiabatic and diabatic behavior of the core-excited states of CH3SH

A. Sevin, M. Tronc, C. Dézarnaud-Dandine, 1992 .

A Theoretical Investigation of Enantioselectivity: Michael Reaction of Secondary Enamines with Enones

C. Giessner-Prettre, A. Sevin, M. Pfau, 1990 .

A mechanistic study of the physical quenching of Mg* by C2H2. Comparison of adiabatic and diabatic potential energy surfaces

A. Sevin, P. Chaquin, A. Papakondylis, 1990 .

Quenching of the 3P and 1P states of Mg by acetylene and possible formation of vinylidene. A theoretical ab initio SCF CI study

A. Sevin, P. Chaquin, A. Papakondylis, 1990 .

Potential energy surfaces of Mg+N2 and quenching of the 3P and 1P states of Mg. A theoretical ab initio SCF CI study

A. Sevin, P. Chaquin, 1988 .

Effects of polyphenols on skin damage due to ultraviolet A rays: an experimental study on rats

A. Sevin, N. Tarimci, P. Öztaş, 2007, Journal of the European Academy of Dermatology and Venereology : JEADV.

Theoretical study of the ground- and excited-state reactivity of sodium and hydrogen fluoride. Comparison of SCF-CI and VB treatments

P. Hiberty, A. Sevin, J. Lefour, 1987 .

Oxygen transfer from iron oxo porphyrins to ethylene: a semiempirical MO/VB approach

M. Fontecave, A. Sevin, 1986 .

Avoided crossings in excited states potential energy surfaces

B. Bigot, A. Sevin, A. Devaquet, 1978 .

Topology of Potential Energy Surfaces: The Complementarity of mo and VB Approaches

A. Sevin, 1986 .

Photochemical behaviour of cyclic s-cis α-oxo oxime ethers. Ab-initio investigation on ethanedial monooxime as model compound†

H. Cerfontain, A. Sevin, F. Stunnenberg, 2010 .

A comparative theoretical analysis of the photochemistry of the methyl radical and related systems

A. Sevin, H. T. Yu, E. Evleth, 1984 .

A comparative theoretical analysis of the photochemistry of the methyl radical and related systems

A. Sevin, H. T. Yu, E. Evleth, 1984 .

Determination of substitutional sites in heterocycles from the topological analysis of the electron localization function (ELF)

B. Silvi, A. Sevin, F. Fuster, 2000, J. Comput. Chem..

Theoretical study of electrophilic versus nucleophilic character of transition metal complexes of phosphinidene

G. Frison, A. Sevin, F. Mathey, 1998 .

Theoretical semi-empirical study of concerted oxidative additions to dinuclear complexes

A. Sevin, P. Chaquin, Yu Hengtai, 1984 .

A cyclobutadiene—palladium complex with a non-planar cyclobutadiene ring obtained from the palladium catalyzed dimerization of an ynamine

J. D'angelo, A. Sevin, J. Ficini, 1979 .

Toward a transition-state model in the asymmetric alkylation of chiral ketone secondary enamines by electron-deficient alkenes. A theoretical MO study

A. Sevin, J. Tortajada, M. Pfau, 1986 .

Mechanism of adamantane rearrangements

Paul von Ragué Schleyer, A. Sevin, E. M. Engler, 1973 .

Electronegativity Versus Lone Pair Shape: A Comparative Study of Phosphaferrocenes and Azaferrocenes

G. Frison, A. Sevin, F. Mathey, 2002 .

Photoenolisation. X.. An ab initio SCF‐CI study

B. Bigot, A. Sevin, M. Pfau, 1979 .

Theoretical ab initio SCF investigation of the photochemical behavior of the three-membered rings. 5. Oxaziridine

R. Ponec, B. Bigot, A. Sevin, 1978 .

Stereochimie—LII. Controle orbitalaire de la stereochimie des reactions—III: Effets des groupes β-fluoro et β-cyano sur la stereochimie et la cinetique de la reduction de cyclohexanones par le tritertiobutoxyaluminohydrure d

A. Sevin, C. Agami, J. Levisalles, 1980 .

Theoretical study of the bonding between aminocarbene and main group elementsElectronic supplementary information (ESI) available: Cartesian coordinates, absolute energies (at B3LYP/6-31G* and B3LYP/6-31+G**//B3LYP/6-31G* levels) and Zero-Point Energy (ZPE) of compounds 1???6. See http://www.rsc.org

G. Frison, A. Sevin, 2002 .

The CH by N Replacement Effects on the Aromaticity and Reactivity of Phosphinines.

N. Avarvari, G. Frison, A. Sevin, 1999, The Journal of organic chemistry.

On the potential catalytic role of electron capture in gas-phase condensation reactions: a theoretical exploratory study of the CH2O2 and CH3ON systems.

H. Chevreau, A. Sevin, F. Gardebien, 2001, Chemphyschem : a European journal of chemical physics and physical chemistry.

A theoretical exploratory study of low-energy (1–2 eV) electron catalysis in the gas phase process

H. Chevreau, A. Sevin, C. Dézarnaud-Dandine, 2000 .

De-aromatizing phosphole.

G. Frison, A. Sevin, F. Mathey, 2002, The Journal of organic chemistry.

A theoretical analysis of the relative roles of ground and excited states in the bond rupture and hydrogen migration pathways in ethyl and vinyl radicals

A. Sevin, H. T. Yu, E. Evleth, 1983 .

Computation of the direct adiabatic channel for the relaxation of electronically excited C2 H5 radical to give H + C2 H4

A. Sevin, E. Evleth, H. Z. Cao, 1984 .

CI study of geometrical relaxation in the excited states of butadiene. Energy surfaces and properties for simultaneous torsion and elongation of one double bond

M. Persico, V. Bonačić‐Koutecký, A. Sevin, 1982 .

Theoretical ab initio SCF investigation on the photochemical behavior of the three-membered rings. 6. Aziridine

B. Bigot, A. Sevin, A. Devaquet, 1980 .

Mechanistic study of the physical quenching of excited lithium by nitrogen: comparison of diabatic and VB potential energy surfaces

P. Hiberty, E. Noizet, C. Giessner-Prettre, 1991 .

Triplet vs. singlet reactivity of 3s13p1 states of magnesium on molecular hydrogen. A theoretical ab initio SCF-CI investigation

A. Sevin, P. Chaquin, Hengtai Yu, 1985 .

AB INITIO SCF CALCULATIONS ON THE PHOTOCHEMICAL BEHAVIOR OF THE THREE-MEMBERED RINGS. 3. OXIRANE: RING OPENING

B. Bigot, A. Sevin, A. Devaquet, 1979 .

THEORETICAL STUDY OF THE ROLE OF VALENCE AND RYDBERG STATES IN THE PHOTOCHEMISTRY OF ETHYLENE

A. Sevin, E. Evleth, 1981 .

eta(5)– and eta(6)–Coordinations Revisited: An ELF Study of Ferrocene and Dibenzenechromium

G. Frison, A. Sevin, 2004 .

Quenching of lithium by nitrogen. A dual theoretical MO-CI and VB investigation of the role of ionic and covalent surfaces

P. Hiberty, A. Sevin, P. Chaquin, 1988 .

A DFT/Electron Localization Function (ELF) Study of the Bonding of Phosphinidenes with N-Heterocyclic Carbenes

G. Frison, A. Sevin, 1999 .

Substituent effects in polarized phosphaalkenes: a theoretical study of aminocarbene–phosphinidene adducts

G. Frison, A. Sevin, 2002 .

Ab initio SCF calculations on the photochemical behavior of the three-membered rings. 4. Oxirane: fragmentation

B. Bigot, A. Sevin, A. Devaquet, 1979 .

Acid-catalyzed rearrangement of spiro[adamantane-2,1'-cyclobutane]: the case for a transannular alkyl shift

D. Farcasiu, A. Sevin, E. Seppo, 1989 .

Electron localization function comparative study of ground state, triplet state, radical anion, and cation in model carbonyl and imine compounds

B. Silvi, A. Sevin, P. Chaquin, 1999, J. Comput. Chem..

Photochemical extrusion of nitrogen in azo compounds. An ab initio SCF-CI study

B. Bigot, A. Sevin, A. Devaquet, 1978 .