Minh Tho Nguyen

Personal Home Page

http://cwisdb.kuleuven.be/persdb-bin/persdb?lang=E&oproep=persoon&fnaam=14440

Articles in Scholarly Journals [Incomplete List]

  1. Minor groove binder antibody conjugates employing a water soluble ß-glucuronide linker
    Bioorganic & Medicinal Chemistry Letters, vol. 17, no. 8, pp. 2278–2280, 2007
  2. The triplet state of indigo: Electronic structure calculations
    Chemical Physics Letters, vol. 449, no. 1-3, pp. 11–17, 2007
  3. Heats of formation of the Criegee formaldehyde oxide and dioxirane
    Chemical Physics Letters, 2007
  4. On the loss of a methyl radical from metastable dimethyl terephthalate molecular ions
    International Journal of Mass Spectrometry, vol. 261, no. 2-3, pp. 134–139, 2007
  5. Molecular mechanism of hydrogen release reactions: Topological analysis using the electron localization function
    Journal of Molecular Structure: THEOCHEM, vol. 811, no. 1-3, pp. 77–89, 2007
  6. Mono-, di-, tri- and tetraphosphatriafulvenes: Electronic structure and aromaticity
    Journal of Molecular Structure: THEOCHEM, vol. 811, no. 1-3, pp. 27–35, 2007
  7. Effects of fluorine-substitution on the molecular properties of dimethyl ethers: A theoretical investigation
    Journal of Molecular Structure: THEOCHEM, vol. 821, no. 1-3, pp. 71–81, 2007
  8. Isomeric Recognition by Ion/Molecule Reactions: The Ionized Phenol-Cyclohexadienone Case
    Journal of the American Society for Mass Spectrometry, 2007
  9. Journal of Physical Chemistry A, vol. 111, no. 1, pp. 113–126, 2007
  10. Molecular Mechanism for H2 Release from BH3NH3, Including the Catalytic Role of the Lewis Acid BH3
    Journal of Physical Chemistry A, vol. 111, no. 4, pp. 679–690, 2007
  11. The Exchange Coupling in Cr3On (n = 0-3) Clusters
    Journal of Physical Chemistry A, vol. 111, no. 20, pp. 4150–4157, 2007
  12. Interaction of Triatomic Germanium with Lithium Atoms: Electronic Structure and Stability of Ge3Lin Clusters
    Journal of Physical Chemistry A, vol. 111, no. 20, pp. 4353–4361, 2007
  13. Heats of Formation of Diphosphene, Phosphinophosphinidene, Diphosphine, and Their Methyl Derivatives, and Mechanism of the Borane-Assisted Hydrogen Release
    Journal of Physical Chemistry A, vol. 111, no. 9, pp. 1726–1736, 2007
  14. Quantum Chemical and Statistical Rate Investigation of the CF2(a3B1) + NO(X2?) Reaction: A Fast Chemical Quenching Process
    Journal of Physical Chemistry A, vol. 111, no. 29, pp. 6628–6636, 2007
  15. Ammonia Triborane: Theoretical Study of the Mechanism of Hydrogen Release
    Journal of Physical Chemistry C, vol. 111, no. 26, pp. 9603–9613, 2007
  16. Computational Study of the Release of H2 from Ammonia Borane Dimer (BH3NH3)2 and Its Ion Pair Isomers
    Journal of Physical Chemistry A, vol. 111, no. 36, pp. 8844–8856, 2007
  17. Use of DFT-based reactivity descriptors for rationalizing radical addition reactions: applicability and difficulties
    Faraday Discussions, vol. 135, p. 191, 2007
  18. Experimental observation and computational identification of Sc@Cu_{16}^{+} , a stable dopant-encapsulated copper cage
    Physical Review A, vol. 76, no. 1, 2007
  19. The geometric, electronic, and magnetic properties of Ag[sub 5]X[sup +] (X=Sc, Ti, V, Cr, Mn, Fe, Co, and Ni) clusters
    The Journal of Chemical Physics, vol. 124, no. 18, p. 184319, 2006
  20. Interaction of diatomic germanium with lithium atoms: Electronic structure and stability
    The Journal of Chemical Physics, vol. 124, no. 21, p. 214312, 2006
  21. The Journal of Physical Chemistry A, vol. 110, no. 13, pp. 4509–4515, 2006
  22. Journal of Physical Chemistry A, vol. 110, no. 28, pp. 8864–8871, 2006
  23. Journal of Physical Chemistry A, vol. 110, no. 37, pp. 10904–10911, 2006
  24. Bioconjugate Chemistry, vol. 17, no. 3, pp. 831–840, 2006
  25. 1-Boryl-3,4-dimethylphosphole trimer: Synthesis, crystal structure and quantum chemical calculations
    Journal of Organometallic Chemistry, vol. 691, no. 19, pp. 4058–4064, 2006
  26. Decarboxylation of Metastable Methyl Benzoate Molecular Ions
    Journal of the American Society for Mass Spectrometry, vol. 17, no. 6, pp. 807–814, 2006
  27. Internal energy effects on charge stripping spectra of [C7H8]+ and [C5H6]+ radical cations
    Chemical Physics Letters, vol. 419, no. 1-3, pp. 139–143, 2006
  28. Characterization of a distonic isomer C6H5C+(OH)OCH2 of methyl benzoate radical cation by associative ion–molecule reactions
    International Journal of Mass Spectrometry, vol. 249-250, pp. 484–492, 2006
  29. Dipeptide-based highly potent doxorubicin antibody conjugates
    Bioorganic & Medicinal Chemistry Letters, vol. 16, no. 2, pp. 358–362, 2006
  30. Theoretical study of the geometric and electronic structure of neutral and anionic doped silver clusters, Ag5X0,- with X=Sc, Ti, V, Cr, Mn, Fe, Co, and Ni
    Chemical Physics, vol. 330, no. 3, pp. 365–379, 2006
  31. Formation of Phosphaethyne Dimers: A Mechanistic Study
    Chemistry - A European Journal, vol. 12, no. 31, pp. 8044–8055, 2006
  32. On the nature of the CP group adjacent to a valence-deficient atom: phosphaethynyl substituent vs. phosphorus center
    Journal of Physical Organic Chemistry, vol. 19, no. 3, pp. 167–172, 2006
  33. Theoretical study of hyperfine coupling constants of uracil, cytosine and their halogenated derivatives in triplet state
    Chemical Physics, vol. 310, no. 1-3, pp. 1–9, 2005
  34. Interaction of triplet uracil and thymine with water
    Chemical Physics, vol. 316, no. 1-3, pp. 35–44, 2005
  35. Energetics and chemical bonding of the 1,3,5-tridehydrobenzene triradical and its protonated form
    Chemical Physics, vol. 316, no. 1-3, pp. 125–140, 2005
  36. Chemical bonding in zwitterionic diamino-meta-quinonoids and their isomers
    Journal of Physical Organic Chemistry, vol. 18, no. 11, pp. 1123–1131, 2005
  37. Spin-philicity and spin-donicity of simple nitrenes and phosphinidenes
    Chemical Physics Letters, vol. 401, no. 4-6, pp. 337–341, 2005
  38. Theoretical study of the kinetics of hydrogen abstraction in reactions of simple hydrogen compounds with triplet difluorocarbene
    Chemical Physics Letters, vol. 402, no. 4-6, pp. 460–467, 2005
  39. Quantum chemical study of the electronic structure of the 1-methylene-3,5-didehydrobenzene triradical (CH)
    Chemical Physics Letters, vol. 404, no. 1-3, pp. 150–155, 2005
  40. A concerted mechanism of proton transfer in green fluorescent protein. A theoretical study
    Chemical Physics Letters, vol. 404, no. 4-6, pp. 250–256, 2005
  41. Effect of protonation on the electronic structure of 1,3,5-trimethylenebenzene triradical
    Chemical Physics Letters, vol. 411, no. 4-6, pp. 450–456, 2005
  42. Theoretical study of the reaction of ketenyl and nitrogen dioxide radicals (HCCO+NO)
    Chemical Physics Letters, vol. 416, no. 4-6, pp. 199–205, 2005
  43. Quantum chemical study of hydrogen abstraction reactions of the ethynyl radical with hydrogen compounds (CH+HX)
    Journal of Molecular Structure: THEOCHEM, vol. 732, no. 1-3, pp. 219–224, 2005
  44. The Journal of Physical Chemistry A, vol. 109, no. 4, pp. 720–720, 2005
  45. The Journal of Physical Chemistry A, vol. 109, no. 12, pp. 2957–2963, 2005
  46. The Journal of Physical Chemistry A, vol. 109, no. 35, pp. 8028–8034, 2005
  47. The Journal of Physical Chemistry A, vol. 109, no. 33, pp. 7489–7499, 2005
  48. The Journal of Physical Chemistry A, vol. 109, no. 36, pp. 8121–8132, 2005
  49. The Journal of Physical Chemistry A, vol. 109, no. 45, pp. 10396–10402, 2005
  50. The Journal of Physical Chemistry A, vol. 109, no. 45, pp. 10342–10347, 2005
  51. The Journal of Physical Chemistry A, vol. 109, no. 48, pp. 10954–10960, 2005
  52. Electronic structure of 1,3,5-triaminobenzene trication and related triradicals: Doublet versus quartet ground state
    The Journal of Chemical Physics, vol. 122, no. 15, p. 154308, 2005
  53. Quenching of the Magnetic Moment of a Transition Metal Dopant in Silver Clusters
    Physical Review Letters, vol. 94, no. 11, 2005
  54. Netropsin interactions in the minor groove of d(GGCCAATTGG) studied by a combination of resolution enhancement and ab initio calculations
    FEBS Journal, vol. 272, no. 14, pp. 3531–3541, 2005
  55. A theoretical study of uracil and its tautomers in their lowest-lying triplet state
    Molecular Physics, vol. 103, no. 6, pp. 983–994, 2005
  56. Rosai-Dorfman Disease of the Breast
    Journal of Women's Imaging, vol. 7, no. 2, pp. 61–64, 2005
  57. A specific gas phase substitution reaction between enol radical cations and t-butyl nitrite
    European Journal of Mass Spectrometry, vol. 10, no. 6, p. 889, 2004
  58. Ab initio study of small graphitic cones with triangle, square, and pentagon apex
    The Journal of Chemical Physics, vol. 121, no. 5, p. 2326, 2004
  59. The triplet state of cytosine and its derivatives: Electron impact and quantum chemical study
    The Journal of Chemical Physics, vol. 121, no. 23, p. 11668, 2004
  60. Theoretical study of the reaction of the ethynyl radical with ammonia (C2H + NH3): hydrogen abstraction versus condensation
    Physical Chemistry Chemical Physics, vol. 6, no. 16, p. 4111, 2004
  61. The Journal of Physical Chemistry A, vol. 108, no. 6, pp. 1101–1101, 2004
  62. The Journal of Physical Chemistry A, vol. 108, no. 3, pp. 484–489, 2004
  63. Journal of Physical Chemistry A, vol. 108, no. 50, pp. 11101–11108, 2004
  64. The Journal of Physical Chemistry A, vol. 108, no. 42, pp. 9283–9293, 2004
  65. The Journal of Physical Chemistry A, vol. 108, no. 51, pp. 11362–11368, 2004
  66. The Journal of Physical Chemistry A, vol. 108, no. 40, pp. 8411–8418, 2004
  67. The Journal of Physical Chemistry A, vol. 108, no. 42, pp. 9169–9179, 2004
  68. The Journal of Physical Chemistry A, vol. 108, no. 31, pp. 6554–6561, 2004
  69. The Journal of Physical Chemistry A, vol. 108, no. 23, pp. 5073–5080, 2004
  70. The Journal of Physical Chemistry A, vol. 108, no. 7, pp. 1268–1274, 2004
  71. Gas phase nitrosation of substituted benzenes
    International Journal of Mass Spectrometry, vol. 232, no. 1, pp. 31–40, 2004
  72. Remarkable influence of fluorine substitution on electronic and thermochemical properties of phospholes
    Chemical Physics Letters, vol. 383, no. 1-2, pp. 138–142, 2004
  73. Direct ab initio dynamics studies of the reactions of HNO with H and OH radicals
    Chemical Physics Letters, vol. 388, no. 1-3, pp. 94–99, 2004
  74. Theoretical study of hydrogenation of thiouracils and their base pairs with adenine
    International Journal of Quantum Chemistry, vol. 99, no. 5, pp. 841–853, 2004
  75. A theoretical approach to the regioselectivity in 1,3-dipolar cycloadditions of diazoalkanes, hydrazoic acid and nitrous oxide to acetylenes, phosphaalkynes and cyanides
    Journal of Physical Organic Chemistry, vol. 16, no. 9, pp. 615–625, 2003
  76. Electronic structure of zwitterionic diamino-meta-quinonoid molecules: identity of UV absorption bands
    Chemical Physics Letters, vol. 382, no. 3-4, pp. 349–354, 2003
  77. Polynitrogen compounds 1. Structure and stability of N4 and N5 systems
    Coordination Chemistry Reviews, vol. 244, no. 1-2, pp. 93–113, 2003
  78. The ring closure of ethylene phosphites is a new P(III)-insertion reaction. A computational study
    Journal of Molecular Structure: THEOCHEM, vol. 633, no. 1, pp. 35–48, 2003
  79. The Journal of Physical Chemistry A, vol. 107, no. 28, pp. 5452–5460, 2003
  80. The Journal of Physical Chemistry A, vol. 107, no. 38, pp. 7514–7523, 2003
  81. The Journal of Physical Chemistry A, vol. 107, no. 43, pp. 9182–9188, 2003
  82. Protonation and methylation of thiophenol, thioanisole and their halogenated derivatives: mass spectrometric and computational study
    International Journal of Mass Spectrometry, vol. 228, no. 2-3, pp. 151–165, 2003
  83. The Journal of Physical Chemistry A, vol. 107, no. 11, pp. 1788–1796, 2003
  84. The Journal of Physical Chemistry A, vol. 107, no. 6, pp. 838–846, 2003
  85. The Journal of Physical Chemistry A, vol. 107, no. 21, pp. 4286–4291, 2003
  86. Density functional study of the decomposition pathways of nitroethane and 2-nitropropaneElectronic supplementary information (ESI) available: The structure of minima on the PES of nitroethane (Fig. S1) and 2-nitropropane (Fig. S2). See http://www.rsc.org/suppdata/cp/b3/b300275f/
    Physical Chemistry Chemical Physics, vol. 5, no. 9, pp. 1730–1738, 2003
  87. An experimental and theoretical study of the reaction of ethynyl radicals with nitrogen dioxide (HC[Triple Bond]C+NO[sub 2])
    The Journal of Chemical Physics, vol. 118, no. 24, p. 10996, 2003
  88. The gas-phase basicity and proton affinity of 1,3,5-cycloheptatriene—energetics, structure and interconversion of dihydrotropylium ions
    European Journal of Mass Spectrometry, vol. 9, no. 4, p. 361, 2003
  89. A quantum chemical study of the protonation of phenylphosphine and its halogenated derivatives
    European Journal of Mass Spectrometry, vol. 9, no. 4, p. 257, 2003
  90. Molecular and electronic structure of zwitterionic diamino- meta -quinonoid molecules
    Molecular Physics, vol. 101, no. 15, pp. 2347–2355, 2003
  91. Theoretical and Experimental Study of the Conformation and Vibrational Frequencies of N-Acetyl-L-alanine and N-Acetyl-L-alaninate
    Spectroscopy Letters, vol. 36, no. 5-6, pp. 537–550, 2003
  92. Enzymatic oxidation of cyclopropylbenzene: structures of new metabolites and possible mechanistic implications
    Canadian Journal of Chemistry, vol. 80, no. 6, pp. 708–713, 2002
  93. Experimental and theoretical study of dicyanocarbene C(CN) 2
    Molecular Physics, vol. 100, no. 11, pp. 1693–1702, 2002
  94. Key properties of monohalogen substituted phenols: interpretation in terms of the electron localization function
    Molecular Physics, vol. 100, no. 11, pp. 1659–1675, 2002
  95. The reaction of C[sub 2]H with H[sub 2]: Absolute rate coefficient measurements and ab initio study
    The Journal of Chemical Physics, vol. 116, no. 9, p. 3700, 2002
  96. Organometallics, vol. 21, no. 15, pp. 3076–3078, 2002
  97. The Journal of Physical Chemistry A, vol. 106, no. 16, pp. 4267–4271, 2002
  98. The Journal of Physical Chemistry A, vol. 106, no. 40, pp. 9319–9324, 2002
  99. Ionized aniline and its distonic radical cation isomers
    International Journal of Mass Spectrometry, vol. 217, no. 1-3, pp. 45–54, 2002
  100. Distonic isomers of ionized benzaldehyde
    International Journal of Mass Spectrometry, vol. 217, no. 1-3, pp. 65–73, 2002
  101. Low energy barriers of H-atom abstraction from phenols
    Journal of Molecular Structure, vol. 615, no. 1-3, pp. 247–250, 2002
  102. Structure–property relationships in phosphole oligomers: a theoretical insight
    Journal of Organometallic Chemistry, vol. 643-644, no. 1-2, pp. 194–201, 2002
  103. Density functional studies on N-fused porphyrin. Electronic, magnetic and metal binding properties
    Journal of Organometallic Chemistry, vol. 643-644, no. 1-2, pp. 265–271, 2002
  104. Collisionally induced loss of NO2 radical from protonated nitroimidazoles and nitropyrazoles
    Chemical Physics Letters, vol. 356, no. 3-4, pp. 259–266, 2002
  105. Theoretical study of the molecular mechanism of the Li(2S1/2)+N2O(X1S+) reaction
    Chemical Physics Letters, vol. 363, no. 5-6, pp. 550–558, 2002
  106. Mechanism of the oxidation reaction of Cu with N2O via nonadiabatic electron transfer
    International Journal of Quantum Chemistry, vol. 89, no. 4, pp. 329–340, 2002
  107. High-energy collisional activation of the molecular ions of thiophene-2-one with different target gases
    Journal of Mass Spectrometry, vol. 36, no. 1, pp. 97–101, 2001
  108. Protonation Thermochemistry of Ethyl Halides
    ChemPhysChem, vol. 2, no. 10, pp. 604–610, 2001
  109. Mononuclear?2(4e)-Bonded Phosphaalkyne Complexes; Selective Formation of a 1,2-Diphosphacyclobutadiene Tantalum Complex
    Angewandte Chemie International Edition, vol. 40, no. 17, pp. 3221–3224, 2001
  110. Decomposition mechanism of the polynitrogen N5 and N6 clusters and their ions
    Chemical Physics Letters, vol. 335, no. 3-4, pp. 311–320, 2001
  111. A Quantum chemical study on the potential energy surface of Mg(1S)+N2O reaction
    Chemical Physics Letters, vol. 344, no. 1-2, pp. 213–220, 2001
  112. Collisional activation of protonated C-halogenopyrazoles
    Chemical Physics Letters, vol. 347, no. 4-6, pp. 465–472, 2001
  113. From localized to delocalized annulenes: how ring strain enhances delocalization in higher annulenes
    Chemical Physics Letters, vol. 349, no. 3-4, pp. 307–312, 2001
  114. A theoretical re-evaluation of the heat of formation of phenylcarbene
    Chemical Physics Letters, vol. 349, no. 5-6, pp. 571–577, 2001
  115. Evidence for the production of propene ion in the gas phase. Reaction of ionized dichlorocarbene with acetone
    Tetrahedron Letters, vol. 42, no. 49, pp. 669–671, 2001
  116. Density functional calculations on protonated and deprotonated thiouracils and their complexes with water
    Chemical Physics, vol. 264, no. 1, pp. 21–35, 2001
  117. The Journal of Physical Chemistry A, vol. 105, no. 5, pp. 838–848, 2001
  118. The Journal of Organic Chemistry, vol. 66, no. 12, pp. 4316–4326, 2001
  119. The Journal of Physical Chemistry A, vol. 105, no. 8, pp. 1288–1295, 2001
  120. The Journal of Physical Chemistry A, vol. 105, no. 10, pp. 1934–1943, 2001
  121. The Journal of Physical Chemistry A, vol. 105, no. 1, pp. 153–155, 2001
  122. The Journal of Physical Chemistry A, vol. 105, no. 13, pp. 3379–3387, 2001
  123. The Journal of Physical Chemistry A, vol. 105, no. 48, pp. 10943–10945, 2001
  124. The Journal of Physical Chemistry A, vol. 105, no. 38, pp. 8709–8717, 2001
  125. The Journal of Physical Chemistry A, vol. 105, no. 37, pp. 8579–8587, 2001
  126. The Journal of Physical Chemistry A, vol. 105, no. 51, pp. 11582–11592, 2001
  127. The Journal of Physical Chemistry A, vol. 105, no. 49, pp. 11128–11133, 2001
  128. The reaction of C2H radicals with C2H6: Absolute rate coefficient measurements for T=295–800 K, and quantum chemical study of the molecular mechanism
    Physical Chemistry Chemical Physics, vol. 3, no. 15, pp. 3070–3074, 2001
  129. Another look at the electron attachment to nitrous oxide
    The Journal of Chemical Physics, vol. 114, no. 18, p. 7911, 2001
  130. Hydrogen bonding in benzonitrile–water complexes
    The Journal of Chemical Physics, vol. 115, no. 2, p. 833, 2001
  131. Triplet–singlet energy gaps in iodo-carbenes (I–C–X): Remarkable discrepancy between theory and experiment
    Physical Chemistry Chemical Physics, vol. 2, no. 22, pp. 5041–5045, 2000
  132. On the triplet–singlet energy gap of acetylene
    The Journal of Chemical Physics, vol. 112, no. 16, p. 7008, 2000
  133. Collisional interaction of ionized pyridine N-oxides with various targets in a new hybrid mass spectrometer
    European Journal of Mass Spectrometry, vol. 6, no. 1, p. 3, 2000
  134. Journal of Organic Chemistry, vol. 65, no. 9, pp. 2631–2636, 2000
  135. Theoretical study of the pentanitrogen cation (N5+)
    Chemical Physics Letters, vol. 317, no. 1-2, pp. 135–141, 2000
  136. The Journal of Physical Chemistry A, vol. 104, no. 24, pp. 5778–5786, 2000
  137. The Journal of Physical Chemistry A, vol. 104, no. 17, pp. 4022–4029, 2000
  138. The Journal of Physical Chemistry A, vol. 104, no. 9, pp. 1905–1914, 2000
  139. Density functional calculations on simple carbonyl bases: protonation and hydrogen bond formation with water
    Chemical Physics, vol. 255, no. 2-3, pp. 149–163, 2000
  140. Experimental and theoretical study of the reaction of the ethynyl radical with acetylene (HC?C+HC?CH)
    Chemical Physics, vol. 262, no. 2-3, pp. 243–252, 2000
  141. Dehalogenation of protonated C-halogeno-1,2,4-triazoles: synthesis of new heterocyclic carbenic and ylid radical cations and contrasting behaviour of collision gases
    International Journal of Mass Spectrometry, vol. 199, no. 1-3, pp. 221–233, 2000
  142. Characterization of ionized carbenes in the gas phase
    International Journal of Mass Spectrometry, vol. 202, no. 1-3, pp. A8–A25, 2000
  143. Theoretical study of the protonation and deprotonation of cytosine. Implications for the interaction of cytosine with water
    Journal of Molecular Structure, vol. 519, no. 1-3, pp. 1–11, 2000
  144. DFT study of the interaction between guanine and water
    Journal of Molecular Structure, vol. 555, no. 1-3, pp. 61–66, 2000
  145. Calculated heats of formation of simple phosphinidenes (phosphanylidenes, R–P)
    Journal of Molecular Structure, vol. 556, no. 1-3, pp. 143–149, 2000
  146. Collisional activation of protonated halogeno-pyridines: different behaviour of target gases
    Chemical Physics Letters, vol. 323, no. 1-2, pp. 71–78, 2000
  147. Contrasting mechanism of the hydration of carbon suboxide and ketene. A theoretical study
    Journal of Physical Organic Chemistry, vol. 13, no. 1, pp. 46–56, 2000
  148. Phosphinidene Transition Metal Complexes: A Combined Ab Initio MO-DFT Study of Cr(CO)5–PR
    European Journal of Inorganic Chemistry, vol. 1999, no. 1, pp. 107–115, 1999
  149. A Density Functional Study of the Dimerization of Phosphaalkynes in the Presence of Transition Metal Fragments
    European Journal of Inorganic Chemistry, vol. 1999, no. 8, pp. 1281–1289, 1999
  150. Theoretical and Experimental (400–10000 cm-1) Study of the Vibrational Spectrum of Pentachlorophenol
    Journal of Molecular Spectroscopy, vol. 195, no. 2, pp. 308–316, 1999
  151. On the heats of formation of methylketene, dimethylketene and related cations
    Chemical Physics Letters, vol. 300, no. 3-4, pp. 346–350, 1999
  152. A quantum chemical study of three isomers of N20
    Chemical Physics Letters, vol. 315, no. 5-6, pp. 327–334, 1999
  153. The Journal of Physical Chemistry A, vol. 103, no. 1, pp. 171–177, 1999
  154. The Journal of Physical Chemistry A, vol. 103, no. 29, pp. 5758–5765, 1999
  155. The Journal of Physical Chemistry A, vol. 103, no. 7, pp. 938–946, 1999
  156. The Journal of Physical Chemistry A, vol. 103, no. 26, pp. 5015–5022, 1999
  157. Journal of the American Chemical Society, vol. 121, no. 25, pp. 5992–6001, 1999
  158. Journal of Organic Chemistry, vol. 64, no. 1, pp. 65–69, 1999
  159. RESEARCH NOTE Theoretical study of the CH3 + NS and related reactions: mechanism of HCN formation
    Molecular Physics, vol. 96, no. 12, pp. 1817–1822, 1999
  160. The hydration mechanism of ketene: 15 years later
    Canadian Journal of Chemistry, vol. 77, no. 5-6, pp. 817–829, 1999
  161. On the heats of formation of formyl cyanide and thioformyl cyanide
    The Journal of Chemical Physics, vol. 110, no. 1, p. 684, 1999
  162. Potential energy surface for unimolecular dissociations and rearrangements of the ground state of [C2H3FO] systems
    Physical Chemistry Chemical Physics, vol. 1, no. 6, pp. 1013–1024, 1999
  163. Potential energy surfaces related to thioxy-hydroxy-carbene (HS?C?OH) and its radical cation
    Physical Chemistry Chemical Physics, vol. 1, no. 5, pp. 755–760, 1999
  164. Journal of Organic Chemistry, vol. 63, no. 20, pp. 6878–6885, 1998
  165. Journal of Organic Chemistry, vol. 63, no. 26, pp. 9669–9677, 1998
  166. The Journal of Physical Chemistry A, vol. 102, no. 18, pp. 3175–3183, 1998
  167. The Journal of Physical Chemistry A, vol. 102, no. 30, pp. 6181–6185, 1998
  168. The Journal of Physical Chemistry A, vol. 102, no. 32, pp. 6549–6557, 1998
  169. The Journal of Physical Chemistry A, vol. 102, no. 29, pp. 6010–6016, 1998
  170. The Journal of Physical Chemistry A, vol. 102, no. 42, pp. 8150–8156, 1998
  171. The Journal of Physical Chemistry A, vol. 102, no. 41, pp. 8013–8020, 1998
  172. The Journal of Physical Chemistry A, vol. 102, no. 34, pp. 6865–6870, 1998
  173. The Journal of Physical Chemistry A, vol. 102, no. 49, pp. 10182–10188, 1998
  174. Theoretical investigations of the gas-phase pre-reactive complexes of oxirane with HF, HCl, F2 and ClF
    Chemical Physics Letters, vol. 283, no. 3-4, pp. 152–160, 1998
  175. The gas-phase RX–NO (X=O, N, S) cations: nitroso onium cations versus ion–molecule complexes
    Chemical Physics Letters, vol. 283, no. 5-6, pp. 357–362, 1998
  176. Stabilization of phosphinidenes by metal complexation: A theoretical study of Cr(CO)–PH
    Chemical Physics Letters, vol. 285, no. 5-6, pp. 429–437, 1998
  177. Theoretical studies on the C?H+O? reaction: mechanism for HCO+CO, HCCO+O and CH+CO? formation
    Chemical Physics Letters, vol. 287, no. 1-2, pp. 109–118, 1998
  178. On the formation of the ?CH?CH?CH=NH? distonic radical cation upon ionization of cyclopropylamine and allylamine
    Chemical Physics Letters, vol. 293, no. 1-2, pp. 90–96, 1998
  179. Theoretical analysis of reactions related to the HNO? energy surface: OH + NO and H + NO?
    Chemical Physics, vol. 230, no. 1, pp. 1–11, 1998
  180. A density functional study of weakly bound hydrogen bonded complexes
    Chemical Physics, vol. 232, no. 3, pp. 299–306, 1998