Thomas Bally
Thomas Bally
professor for physical chemistry, University of Fribourg, Switzerland
Verified email at unifr.ch
TitleCited byYear
Incorrect dissociation behavior of radical ions in density functional calculations
T Bally, GN Sastry
The Journal of Physical Chemistry A 101 (43), 7923-7925, 1997
3111997
Cyclobutadiene
T Bally, S Masamune
Tetrahedron 36 (3), 343-370, 1980
2961980
Cyclotrisilane (R2Si) 3 and disilene (R2Si: SiR2) system: synthesis and characterization
S Masamune, Y Hanzawa, S Murakami, T Bally, JF Blount
Journal of the American Chemical Society 104 (4), 1150-1153, 1982
2481982
Organic radical ions in rigid systems
T Shida, E Haselbach, T Bally
Accounts of Chemical Research 17 (5), 180-186, 1984
2381984
Calculating accurate proton chemical shifts of organic molecules with density functional methods and modest basis sets
R Jain, T Bally, PR Rablen
The Journal of organic chemistry 74 (11), 4017-4023, 2009
2192009
Calculations on open-shell molecules: a beginner's guide
T Bally, WT Borden
Reviews in computational chemistry 13, 1-98, 1999
1991999
The C7H6 potential energy surface revisited: relative energies and IR assignment
S Matzinger, T Bally, EV Patterson, RJ McMahon
Journal of the American Chemical Society 118 (6), 1535-1542, 1996
1871996
Quantum-Chemical Simulation of 1H NMR Spectra. 2. Comparison of DFT-Based Procedures for Computing Proton–Proton Coupling Constants in Organic Molecules
T Bally, PR Rablen
The Journal of organic chemistry 76 (12), 4818-4830, 2011
1262011
Electronic Absorption Spectra of Neutral Pentacene (C22H14) and Its Positive and Negative Ions in Ne, Ar, and Kr Matrices
TM Halasinski, DM Hudgins, F Salama, LJ Allamandola, T Bally
The Journal of Physical Chemistry A 104 (32), 7484-7491, 2000
1232000
Pentalene: formation, electronic, and vibrational structure
T Bally, S Chai, M Neuenschwander, Z Zhu
Journal of the American Chemical Society 119 (8), 1869-1875, 1997
1031997
Matrix isolation, time-resolved IR, and computational study of the photochemistry of benzoyl azide
EA Pritchina, NP Gritsan, A Maltsev, T Bally, T Autrey, Y Liu, Y Wang, ...
Physical Chemistry Chemical Physics 5 (6), 1010-1018, 2003
1022003
Stable polarons in polyacetylene oligomers: Optical spectra of long polyene radical cations
T Bally, K Roth, W Tang, RR Schrock, K Knoll, LY Park
Journal of the American Chemical Society 114 (7), 2440-2446, 1992
1011992
Studies on Radical Cations, III. The Type C Valence‐Isomeric System Quadricyclane Radical Cation/Norbornadiene Radical Cation
E Haselbach, T Bally, Z Lanyiova, P Baertschi
Helvetica Chimica Acta 62 (2), 583-592, 1979
931979
Excited states of polyene radical cations: limitations of Koopmans' theorem
T Bally, S Nitsche, K Roth, E Haselbach
Journal of the American Chemical Society 106 (14), 3927-3933, 1984
881984
Reversible interconversion between singlet and triplet 2-naphthyl (carbomethoxy) carbene
Z Zhu, T Bally, LL Stracener, RJ McMahon
Journal of the American Chemical Society 121 (12), 2863-2874, 1999
861999
The C4H8. bul.+ potential energy surface. 2. The (C2H4) 2. bul.+ complex cation and its reaction to the radical cations of cyclobutane and 1-butene
P Jungwirth, T Bally
Journal of the American Chemical Society 115 (13), 5783-5789, 1993
781993
Quadrannulene: A nonclassical fullerene fragment
R Bhola, T Bally, A Valente, MK Cyrański, Ł Dobrzycki, SM Spain, ...
Angewandte Chemie International Edition 49 (2), 399-402, 2010
77*2010
Concerning the Conformation of Isolated Benzylideneaniline
T Bally, E Haselbach, S Lanyiova, M Rossi, F Marschner
Helvetica Chimica Acta 59 (2), 486-498, 1976
761976
The C4H4•+ Potential Energy Surface. 3. The Reaction of Acetylene with Its Radical Cation
V Hrouda, M Roeselova, T Bally
The Journal of Physical Chemistry A 101 (21), 3925-3935, 1997
741997
Cyclobutadiene: the antiaromatic paradigm?
T Bally
Angewandte Chemie International Edition 45 (40), 6616-6619, 2006
712006
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Articles 1–20