Grapperhaus, C. A.; Bill, E.; Weyhermüller, T.; Neese, F.; Wieghardt, K. Molecular and Electronic Structure of [Mn^VN(cyclam−acetato)]PF₆. A Combined Experimental and DFT Study. Inorganic Chemistry 2001, 40, 4191–4198.

Walther, D.; Döhler, T.; Theyssen, N.; Görls, H. Di-, Tri-, and Tetranuclear Complexes of Ni, Pd, and Zn with Oxalamidinato Bridges: Syntheses, Structures and Catalytic Reactions. European Journal of Inorganic Chemistry 2001, 2001, 2049–2060.

Lin, H.; Bürger, H.; Mkadmi, E. B.; He, S.-G.; Yuan, L.-F.; Breidung, J.; Thiel, W.; Huet, T. R.; Demaison, J. The Si–H stretching–bending overtone polyads of SiHF₃: Assignments, band intensities, internal coordinate force field, and ab initio dipole moment surfaces. The Journal of Chemical Physics 2001, 115, 1378–1391.

Geiger, J.; Korte, E.-H.; Schrader, W. Development of a simple gradient LC–IR interface for the detection of terpenoids from the α-pinene–ozone reaction. Journal of Chromatography A 2001, 992, 99–110.

Schrader, W.; Geiger, J.; Klockow, D.; Korte, E.-H. Degradation of α-Pinene on Tenax during Sample Storage:  Effects of Daylight Radiation and Temperature. Environmental Science & Technology 2001, 35, 2717–2720.

Lin, H.; Bürger, H.; He, S.-G.; Yuan, L.-F.; Breidung, J.; Thiel, W. Overtones of the Si−H Stretching−Bending Polyad in SiHD₃: Internal Coordinate Force Field, ab initio Dipole Moment Surfaces, and Band Intensities. The Journal of Physical Chemistry A 2001, 105, 6065–6072.

Döhring, A.; Jensen, V. R.; Jolly, P. W.; Thiel, W.; Weber, J. C. Donor-Ligand-Substituted Cyclopentadienylchromium(III) Complexes:  A New Class of Alkene Polymerization Catalyst. 2. Phosphinoalkyl-Substituted Systems. Organometallics 2001, 20, 2234–2245.

Bürger, H.; Lecoutre, M.; Huet, T. R.; Breidung, J.; Thiel, W.; Hänninen, V.; Halonen, L. The (n00), n=3, 4, and 6, local mode states of H₃SiD: Fourier transform infrared and laser photoacoustic spectra and ab initio calculations of spectroscopic parameters. The Journal of Chemical Physics 2001, 114, 8844–8854.

Aguilera, B.; Wolf, L. B.; Nieczypor, P.; Rutjes, F. P. J. T.; Overkleeft, H. S.; van Hest, J. C. M.; Schoemaker, H. E.; Wang, B.; Mol, J. C.; Fürstner, A.; Overhand, M.; van der Marel, G. A.; van Boom, J. H. Synthesis of Diaminosuberic Acid Derivatives via Ring-Closing Alkyne Metathesis. The Journal of Organic Chemistry 2001, 66, 3584–3589.

Chen, Z.; Jiao, H.; Hirsch, A.; Thiel, W. BN-Doped Fullerenes:  An NICS Characterization. The Journal of Organic Chemistry 2001, 66, 3380–3383.

Krause, J.; Goddard, R.; Mynott, R.; Pörschke, K.-R. A Dinuclear Palladium(I) Ethynyl Complex: Synthesis, Structure, and Dynamics. Organometallics 2001, 20, 1992–1999.

Chen, Z.; Jiao, H.; Hirsch, A.; Thiel, W. The 2(N+1)² rule for spherical aromaticity: further validation. Journal of Molecular Modeling 2001, 7, 161–163.

Lange de Oliveira, A.; Wolf, A.; Schüth, F. Highly selective propene epoxidation with hydrogen/oxygen mixtures over titania-supported silver catalysts. Catalysis Letters 2001, 73, 157–160.

Neese, F. Theoretical Study of Ligand Superhyperfine Structure. Application to Cu(II) Complexes. The Journal of Physical Chemistry A 2001, 105, 4290–4299.

Fürstner, A.; Krause, H. Practical Method for the Rhodium-Catalyzed Addition of Aryl- and Alkenylboronic Acids to Aldehydes. Advanced Synthesis & Catalysis 2001, 343, 343–350.

Neese, F. Configuration interaction calculation of electronic g tensors in transition metal complexes. International Journal of Quantum Chemistry 2001, 83, 104–114.

Kleitz, F.; Schmidt, W.; Schüth, F. Evolution of mesoporous materials during the calcination process: structural and chemical behavior. Microporous and Mesoporous Materials 2001, 44-45, 95–109.

Möhle, K.; Hofmann, H.-J.; Thiel, W. Description of peptide and protein secondary structures employing semiempirical methods. Journal of Computational Chemistry 2001, 22, 509–520.

Marlow, F.; Kleitz, F. Mesoporous silica fibers: internal structure and formation. Microporous and Mesoporous Materials 2001, 44-45, 671–677.

Schüth, F.; Wingen, A.; Sauer, J. Oxide loaded ordered mesoporous oxides for catalytic applications. Microporous and Mesoporous Materials 2001, 44-45, 465–476.