Mindless chemistry PP Bera, KW Sattelmeyer, M Saunders, HF Schaefer, PR Schleyer The Journal of Physical Chemistry A 110 (13), 4287-4290, 2006 | 184 | 2006 |
Aromaticity: The Alternating C C Bond Length Structures of [14]‐,[18]‐, and [22] Annulene CS Wannere, KW Sattelmeyer, HF Schaefer III, PR Schleyer Angewandte Chemie International Edition 43 (32), 4200-4206, 2004 | 166 | 2004 |
Comparison of SCC-DFTB and NDDO-based semiempirical molecular orbital methods for organic molecules KW Sattelmeyer, J Tirado-Rives, WL Jorgensen The Journal of Physical Chemistry A 110 (50), 13551-13559, 2006 | 165 | 2006 |
Use of 2h and 3h− p-like coupled-cluster Tamm–Dancoff approaches for the equilibrium properties of ozone KW Sattelmeyer, HF Schaefer Iii, JF Stanton Chemical physics letters 378 (1-2), 42-46, 2003 | 100 | 2003 |
On the vertical excitation energy of cyclopentadiene YJ Bomble, KW Sattelmeyer, JF Stanton, J Gauss The Journal of chemical physics 121 (11), 5236-5240, 2004 | 72 | 2004 |
Binding energies of small lithium clusters (Lin) and hydrogenated lithium clusters (LinH) SE Wheeler, KW Sattelmeyer, PR Schleyer, HF Schaefer The Journal of chemical physics 120 (10), 4683-4689, 2004 | 70 | 2004 |
Computational Studies of C6H2 Isomers KW Sattelmeyer, JF Stanton Journal of the American Chemical Society 122 (34), 8220-8227, 2000 | 45 | 2000 |
On the photoelectron spectrum of p-benzoquinone JF Stanton, KW Sattelmeyer, J Gauss, M Allan, T Skalicky, T Bally The Journal of chemical physics 115 (1), 1-4, 2001 | 44 | 2001 |
NO-MNDO: Reintroduction of the Overlap Matrix into MNDO KW Sattelmeyer, I Tubert-Brohman, WL Jorgensen Journal of Chemical Theory and Computation 2 (2), 413-419, 2006 | 41 | 2006 |
Electronic spectrum of propadienylidene (H2C= C= C:) and its relevance to the diffuse interstellar bands JA Hodges, RJ McMahon, KW Sattelmeyer, JF Stanton The Astrophysical Journal 544 (2), 838, 2000 | 41 | 2000 |
A comparison of excited state properties for iterative approximate triples linear response coupled cluster methods KW Sattelmeyer, JF Stanton, J Olsen, J Gauss Chemical physics letters 347 (4-6), 499-504, 2001 | 38 | 2001 |
The vibrational frequency of the vinyl radical: Conflict between theory and experiment KW Sattelmeyer, HF Schaefer III The Journal of Chemical Physics 117 (17), 7914-7916, 2002 | 29 | 2002 |
The global minimum structure of The controversy continues KW Sattelmeyer, HF Schaefer III, JF Stanton The Journal of chemical physics 116 (21), 9151-9153, 2002 | 26 | 2002 |
Triplet H−C−SiHCl2: Combined Matrix-IR and CCSD(T) Identification, and the Role of the Open-Shell Singlet State PR Schreiner, HP Reisenauer, WD Allen, KW Sattelmeyer Organic Letters 6 (7), 1163-1166, 2004 | 24 | 2004 |
H−C−SiH3: Direct Generation and Spectroscopic Identification of Ethylidene's Cousin PR Schreiner, HP Reisenauer, KW Sattelmeyer, WD Allen Journal of the American Chemical Society 127 (35), 12156-12157, 2005 | 22 | 2005 |
Energetics of the low-lying isomers of HCCO KW Sattelmeyer, Y Yamaguchi, HF Schaefer Iii Chemical physics letters 383 (3-4), 266-269, 2004 | 21 | 2004 |
Characterization of the three lowest-lying singlet electronic states of AlOH S Li, KW Sattelmeyer, Y Yamaguchi, HF Schaefer III The Journal of chemical physics 119 (24), 12830-12841, 2003 | 19 | 2003 |
The equilibrium structure of the ammonium radical Rydberg ground state KW Sattelmeyer, HF Schaefer III, JF Stanton The Journal of chemical physics 114 (22), 9863-9865, 2001 | 12 | 2001 |
Elusive electron affinity of ClF Ľ Horný, KW Sattelmeyer, HF Schaefer III The Journal of chemical physics 119 (22), 11615-11619, 2003 | 10 | 2003 |
Delocalizations in σ-Radical Cations: The Intriguing Structures of Ionized [n]Rotanes AA Fokin, PR Schreiner, SI Kozhushkov, KW Sattelmeyer, HF Schaefer, ... Organic letters 5 (5), 697-700, 2003 | 9 | 2003 |