[ press & media ] [ cover gallery ]
| 85. |
F. A. Perras, C. M. Widdifield,
and D. L. Bryce QUEST - Quadrupolar Exact Software: a Fast Graphical Program for the Exact Simulation of NMR and NQR Spectra for Quadrupolar Nuclei Solid State Nucl. Magn. Reson., in press (2012).  Download QUEST software here |
| 84. |
K. M. N. Burgess, F. A. Perras,
A. Lebrun, E. Messner-Henning, I.
Korobkov,
and D. L. Bryce Sodium-23 Solid-State Nuclear Magnetic Resonance of Commercial Sodium Naproxen and its Solvates J. Pharm. Sci., (2012), in press.  |
| 83. |
F. A. Perras and D. L. Bryce Direct Investigation of Covalently Bound Chlorine in Organic Compounds by Solid-State 35Cl NMR Spectroscopy and Exact Spectral Line-Shape Simulations Angew. Chem. Int. Ed., 51, 4227-4230 (2012). PDF. Angew. Chem, 124, 4303-4306 (2012). PDF.  |
| 82. |
D. L. Bryce Halogen Bonding Chem. Int., 34, 27-29 (2012). |
| 81. |
M. Jeletic, F. A. Perras, S. I.
Gorelsky, J. J. Le Roy, I. Korobkov, D. L. Bryce, and M. Murugesu First Structural Evidence for Multiple Alkali Metals between Sandwich Decks in a Metallocene Dalton Trans., in press (2012).  |
| 80. |
S.-W. Oh, J. W. E. Weiss, P. A.
Kerneghan, I.
Korobkov, K. E. Maly, and D. L. Bryce Solid-State 11B and 13C NMR, IR, and X-ray Crystallographic Characterization of Selected Arylboronic Acids and Their Catechol Cyclic Esters Magn. Reson. Chem., 50, 388-401 (2012). PDF.  |
| 79. |
R. J. Attrell, C. M. Widdifield,
I. Korobkov, and D. L. Bryce Weak Halogen Bonding in Solid Haloanilinium Halides Probed Directly via Chlorine-35, Bromine-81, and Iodine-127 NMR Spectroscopy Cryst. Growth Des., 12, 1641-1653 (2012). PDF.  |
| 78. |
C. J. Capicciotti, M. Leclere,
F. A. Perras, D. L. Bryce, H. Paulin, J. Harden, and R. N. Ben Potent Inhibition of Ice Recrystallization by Low Molecular Weight Carbohydrate-based Surfactants and Hydrogelators Chem. Sci. 3, 1408-1416 (2012). PDF. Cover article. 
 |
| 77. |
F. A. Perras, I.
Korobkov, and
D. L. Bryce 23Na Double-Rotation NMR of Sodium Nucleotides Leads to the Discovery of a New dCMP Hendecahydrate Phys. Chem. Chem. Phys., 14, 4677-4681 (2012). PDF.  |
| 76. |
C. M. Widdifield, T. Jurca, D.
S. Richeson, and D. L. Bryce Using 69/71Ga Solid-State NMR and 127I NQR as Probes to Elucidate the Composition of "GaI" Polyhedron, 35, 96-100 (2012). PDF.  |
| 75. |
K. M. N. Burgess, I.
Korobkov,
and D. L. Bryce A Combined Solid-State NMR and X-ray Crystallography Study of the Bromide Anion Environments in Triphenylphosphonium Bromides Chem. Eur. J., 18, 5748-5758 (2012). PDF.  |
| 74. |
D. L. Bryce and R. E. Wasylishen Quadrupolar Nuclei in Solids: Influence of Different Interactions on Spectra a) Chapter 4 in 'NMR of Quadrupolar Nuclei in Solid Materials'; R. E. Wasylishen, S. E. Ashbrook, and S. Wimperis, Eds.; John Wiley and Sons Ltd., Chichester, UK, (2012), in press. Invited contribution. b) In 'Encyclopedia of Magnetic Resonance'; R. K. Harris and R. E. Wasylishen, Eds.; Wiley (2011). Invited contribution.  |
| 73. |
J. Viger-Gravel, I. Korobkov,
and D. L. Bryce Multinuclear Solid-State Magnetic Resonance and X-ray Diffraction Study of Some Thiocyanate and Selenocyanate Complexes Exhibiting Halogen Bonding Cryst. Growth Des., 11, 4984-4995 (2011). PDF Invited contribution.  |
| 72. |
F. A. Perras and D. L. Bryce Residual Dipolar Coupling Between Quadrupolar Nuclei Under Magic-Angle Spinning and Double-Rotation Conditions J. Magn. Reson., 213, 82-89 (2011). PDF.  |
| 71. |
D. L. Bryce, G. Wu, and Y. Huang Tribute: Professor Roderick E. Wasylishen / Un hommage à Roderick E. Wasylishen Can. J. Chem., 89, xi-xvi (2011). PDF. |
| 70. |
C. M. Widdifield, A. D. Bain,
and D. L. Bryce Definitive Solid-State 185/187Re NMR Spectral Evidence for and Analysis of the Origin of High-Order Quadrupole-Induced Effects for I = 5/2 Phys. Chem. Chem. Phys., 13, 12413-12420 (2011). PDF. Cover article.   |
| 69. |
F. A. Perras and D. L. Bryce Removal of Sidebands in Double-Rotation NMR in Real Time J. Magn. Reson., 211, 234-239 (2011). PDF.  |
| 68. |
P. A. Kernaghan, S. D. Halperin,
D. L. Bryce, and K. E. Maly Postsynthetic Modification of an Imine-Based Microporous Organic Network Can. J. Chem., 89, 577-582, (2011). PDF.  |
| 67. |
D. L. Bryce, C. M. Widdifield,
R. P. Chapman, and R. J. Attrell Chlorine, Bromine, and Iodine Solid-State NMR a) Chapter 19 in 'NMR of Quadrupolar Nuclei in Solid Materials'; R. E. Wasylishen, S. E. Ashbrook, and S. Wimperis, Eds.; John Wiley and Sons Ltd., Chichester, UK, (2012), in press. b) In 'Encyclopedia of Magnetic Resonance'; R. K. Harris and R. E. Wasylishen, Eds.; Wiley (2011). PDF. Invited contribution. |
| 66. |
C. M. Widdifield and D. L. Bryce A Multinuclear Solid-State Magnetic Resonance and GIPAW DFT Study of Anhydrous Calcium Chloride and its Hydrates Can. J. Chem., 89, 754-763 (2011). PDF. Special issue; invited contribution.  |
| 65. |
R. P. Chapman, J. R. Hiscock, P.
A. Gale, and D. L. Bryce A Solid-State 35/37Cl NMR Study of a Chloride Ion Receptor and GIPAW-DFT Study of Chlorine NMR Interaction Tensors in Organic Hydrochlorides Can. J. Chem., 89, 822-834 (2011). PDF. Special issue; invited contribution.  |
| 64. |
F. A. Perras and D. L Bryce A ZORA-DFT and NLMO Study of the One-Bond Fluorine-X Indirect Nuclear Spin-Spin Coupling Tensors for Various VSEPR Geometries Can. J. Chem., 89, 789-802 (2011). PDF. Special issue; invited contribution.  |
| 63. |
A. Y. H. Lo, T. Jurca, D. S.
Richeson, and D. L. Bryce Multinuclear Solid-State Magnetic Resonance Study of In+ and Ag+ in Neutral Weakly Coordinating Environments J. Phys. Chem. Lett., 1, 3078-3084 (2010). PDF.  |
| 62. |
C. M. Widdifield and D. L. Bryce Solid-State 127I NMR and GIPAW DFT Study of Metal Iodides and their Hydrates: Structure, Symmetry, and Higher-Order Quadrupole-Induced Effects J. Phys. Chem. A, 114, 10810-10823 (2010). PDF.  |
| 61. |
D. L. Bryce Calcium Binding Environments Probed by 43Ca NMR Spectroscopy Dalton Trans., 39, 8593-8602 (2010). PDF. Cover article. Invited contribution. Press: SpectroscopyNow  |
| 60. |
D. L. Bryce A Computational Investigation of J Couplings Involving 27Al, 17O, and 31P Magn. Reson. Chem., 48, S69-S75 (2010). PDF. Special issue; invited contribution.  |
| 59. |
J. W. E. Weiss and D. L. Bryce A Solid-State 11B NMR and Computational Study of Boron Electric Field Gradient and Chemical Shift Tensors in Boronic Acids and Boronic Esters J. Phys. Chem. A, 114, 5119-5131 (2010). PDF.  |
| 58. |
M. J. Plevin, D. L. Bryce, and
J. Boisbouvier Direct Detection of CH/pi Interactions in Proteins Nature Chem. 2, 466-471 (2010). PDF. Press: CNRS, France; Nature Chemistry highlight; Faculty of 1000 "Exceptional" rating; uOttawa news release; bulletin electronique; Radio-Canada interview  |
| 57. |
P. D. Frischmann, G. A. Facey,
P. Ghi, A. J. Gallant, D. L. Bryce, F. Lelj, and M. J. MacLachlan Capsule Formation, Carboxylate Exchange, and DFT Exploration of Cadmium Cluster Metallocavitands: Highly Dynamic Supramolecules J. Am. Chem. Soc., 132, 3893-3908 (2010). PDF.  |
| 56. |
C. M. Widdifield and D. L. Bryce Solid-State 79/81Br NMR and Gauge-Including Projector-Augmented Wave Study of Structure, Symmetry, and Hydration State in Alkaline Earth Metal Bromides J. Phys. Chem. A, 114, 2102-2116 (2010). PDF.  |
| 55. |
T. Pathmalingam, F. Habib, C. M.
Widdifield, F. Loiseau, T. J. Burchell, S. I. Gorelsky, A. M.
Beauchemin, D. L. Bryce, and M. Murugesu Combining Oximes with Azides to Create a Novel 1D Chain [NaCoIII2] System: Synthesis, Structure, and Solid-State NMR Dalton Trans., 39, 1504-1510 (2010). PDF.  |
| 54. |
D. L. Bryce, N. M. Dorval
Courchesne, and F. A. Perras Measurement of Δ1J(199Hg,31P) in [HgPCy3(OAc)2]2 and Relativistic ZORA DFT Investigations of Mercury-Phosphorus Coupling Tensors Solid State Nucl. Magn. Reson., 36, 182-191 (2009). PDF.  |
| 53. |
D. L. Bryce Tensor Interplay In 'NMR Crystallography'; R. K. Harris, R. E. Wasylishen, and M. J. Duer, Eds.; John Wiley and Sons Ltd., Chichester, UK, pp 289-301 (2009). PDF. Invited contribution.  |
| 52. |
C. M. Widdifield and D. L. Bryce Crystallographic Structure Refinement with Quadrupolar Nuclei: a Combined Solid-State NMR and GIPAW DFT Example Using MgBr2 Phys. Chem. Chem. Phys., 11, 7120-7122 (2009). PDF. Highlighted by PCCP as a top-cited paper.  |
| 51. |
R. P. Chapman and D. L. Bryce Application of Multinuclear Magnetic Resonance and Gauge-Including Projector-Augmented Wave Calculations to the Study of Solid Group 13 Chlorides Phys. Chem. Chem. Phys., 11, 6987-6998 (2009). PDF. Special issue; invited contribution.  |
| 50. |
R. P. Chapman, C. M. Widdifield,
and D. L. Bryce Solid-State NMR of Quadrupolar Halogen Nuclei Prog. Nucl. Magn. Reson. Spectrosc., 55, 215-237 (2009). PDF. Invited contribution. |
| 49. |
K. J. Harris, D. L. Bryce, and
R. E. Wasylishen NMR Line Shapes from AB Spin Systems in Solids: The Role of Antisymmetric Spin-Spin Coupling Can. J. Chem., 87, 1338-1351 (2009). PDF. Special issue; invited contribution. |
| 48. |
D. L. Bryce and J. Autschbach Relativistic Hybrid Density Functional Calculations of Indirect Nuclear Spin-Spin Coupling Tensors. Comparison with Experiment for Diatomic Alkali Metal Halides. Can. J. Chem., 87, 927-941 (2009). PDF. Special issue; invited contribution.  |
| 47. |
C. M. Widdifield, R. P. Chapman,
and D. L. Bryce Chlorine, Bromine, and Iodine Solid-State NMR Spectroscopy Annu. Rep. Nucl. Magn. Reson. Spectrosc., 66, 195-326 (2009). PDF. Invited contribution. |
| 46. |
D. L. Bryce Tensor Interplay In 'Encyclopedia of Magnetic Resonance'; R. K. Harris and R. E. Wasylishen, Eds.; Wiley (2008). PDF. Invited contribution. |
| 45. |
D. L. Bryce, E. B. Bultz, and D.
Aebi Calcium-43 Chemical Shift Tensors as Probes of Calcium Binding Environments. Insight into the Structure of the Vaterite CaCO3 Polymorph by 43Ca Solid-State NMR Spectroscopy. J. Am. Chem. Soc., 130, 9282-9292 (2008). PDF. Press: SpectroscopyNow  |
| 44. |
H. Van Melckebeke, M. Devany, C.
Di Primo, F. Beaurain, J.-J. Toulme, D. L. Bryce, and J. Boisbouvier Liquid Crystal NMR Structure of HIV TAR RNA Bound to its SELEX RNA Aptamer Reveals the Origins of the High Stability of the Complex Proc. Natl. Acad. Sci. USA, 105, 9210-9215 (2008). PDF. Press: Biotech Info; HPCVL; CEA Press release  |
| 43. |
P. Crewdson, D. L. Bryce, F.
Rominger, and P. Hofmann Application of Ultrahigh-Field 59Co Solid-State NMR Spectroscopy in the Investigation of the 1,2-Polybutadiene Catalyst [Co(C8H13)(C4H6)] Angew. Chem. Int. Ed., 47, 3454-3457 (2008). PDF. Angew. Chem., 120, 3503-3507 (2008). PDF.  |
| 42. |
G.
D. Batema, M. Lutz, A. L.
Spek, C. A. van Walree, C. de Mello Donega, A. Meijerink, R. W. A.
Havenith, J. Perez-Moreno, K. Clays, M. Buchel, A. van Dijken, D. L.
Bryce, G. P. M. van Klink, and G. van Koten Substituted 4,4'-Stilbenoid NCN-Pincer Platinum(II) Complexes. Luminescence and Tuning of the Electronic and NLO Properties and the Application in an OLED Organometallics, 27, 1690-1701 (2008). PDF. |
| 41. |
R. P. Chapman and D. L. Bryce A High-Field Solid-State 35/37Cl NMR and Quantum Chemical Investigation of the Chlorine Quadrupolar and Chemical Shift Tensors in Amino Acid Hydrochlorides Phys. Chem. Chem. Phys., 9, 6219-6230 (2007). PDF.  |
| 40. |
P. K. Lee, R. P. Chapman, L.
Zhang, J. Hu, L. J. Barbour, E. K. Elliott, G. W. Gokel, and D. L. Bryce K-39 Quadrupolar and Chemical Shift Tensors for Organic Potassium Complexes and Diatomic Molecules J. Phys. Chem. A, 111, 12859-12863 (2007). PDF.  |
| 39. |
S. Adiga, D. Aebi, and D. L.
Bryce EFGShield: A Program for Parsing and Summarizing the Results of Electric Field Gradient and Nuclear Magnetic Shielding Tensor Calculations Can. J. Chem., 85, 496-505 (2007). PDF. Cover article. 
 Download the EFGShield program here |
| 38. |
D. L. Bryce and E. B. Bultz Alkaline Earth Chloride Hydrates: Chlorine Quadrupolar and Chemical Shift Tensors by Solid-State NMR Spectroscopy and Plane Wave Pseudopotential Calculations Chem. Eur. J., 13, 4786-4796 (2007). PDF.  |
| 37. |
D. L. Bryce and G. D. Sward Chlorine-35/37 NMR Spectroscopy of Solid Amino Acid Hydrochlorides: Refinement of Hydrogen-Bonded Proton Positions Using Experiment and Theory J. Phys. Chem. B, 110, 26461-26470 (2006). PDF. |
| 36. |
D. L. Bryce, S. Adiga, E. K.
Elliott, and G. W. Gokel A Solid-State 23Na NMR Study of Sodium Lariat Ether Receptors Exhibiting Cation-pi Interactions J. Phys. Chem. A, 110, 13568-13577 (2006). PDF. |
| 35. |
H. M. Foucault, D. L. Bryce, and
D. E. Fogg A Chelate-Stabilized Ruthenium(s-Pyrrolato) Complex: Resolving Ambiguities in Nuclearity and Coordination Geometry through 1H PGSE and 31P Solid-State NMR Studies Inorg. Chem., 45, 10293-10299 (2006). PDF.  |
| 34. |
J. Ying, A. Grishaev, D. L.
Bryce, and A. Bax Chemical Shift Tensors of Protonated Base Carbons in Helical RNA from NMR Relaxation and Liquid Crystal Measurements J. Am. Chem. Soc., 128, 11443-11454 (2006). PDF. |
| 33. |
D. L. Bryce Spin-Spin Coupling Constants in Homonuclear Polynitrogen Species Phys. Chem. Chem. Phys., 8, 3379-3382 (2006). PDF. Cover article.  |
| 32. |
D. L. Bryce, G. D. Sward, and S.
Adiga Solid-State 35/37Cl NMR Spectroscopy of Hydrochloride Salts of Amino Acids Implicated in Chloride Ion Transport Channel Selectivity: Opportunities at 900 MHz J. Am. Chem. Soc. 128, 2121-2134 (2006). PDF.  |
| 31. |
D. L. Bryce and G. D. Sward Solid-State NMR Spectroscopy of the Quadrupolar Halogens: Chlorine-35/37, Bromine-79/81, and Iodine-127 Magn. Reson. Chem. 44, 409-450 (2006). PDF. |
| 30. |
D. L. Bryce, A. Grishaev, and
A. Bax
Measurement of Ribose Carbon
Chemical Shift Tensors for A-form RNA by Liquid Crystal NMR
Spectroscopy
J.
Am. Chem. Soc. 127, 7387-7396 (2005). PDF.
 |
| 29. |
J. Boisbouvier, D.L. Bryce, E.
O'Neil-Cabello, E.P. Nikonowicz, and
A. Bax Resolution-optimized NMR measurement of 1DCH, 1DCC and 2DCH residual dipolar couplings in nucleic acid bases. J. Biomol. NMR 30, 287-301 (2004). PDF. |
| 28. |
E. O'Neil-Cabello,
Z. Wu, D.L.
Bryce, E.P. Nikonowicz, and A. Bax Enhanced spectral resolution in RNA HCP spectra for measurement of 3JC2'P and 3JC4'P couplings and 31P chemical shift changes upon weak alignment. J. Biomol. NMR 30, 61-70 (2004). PDF. |
| 27. |
E. Miclet, D.C.
Williams Jr., G.
M. Clore, D.L. Bryce, J.
Boisbouvier and A. Bax Relaxation-Optimized NMR Spectroscopy of Methylene Groups in Proteins and Nucleic Acids. J. Am. Chem. Soc. 126, 10560-10570 (2004). PDF. |
| 26. |
D.L. Bryce, J. Boisbouvier, and
A. Bax Experimental and Theoretical Determination of Nucleic Acid Magnetic Susceptibility: Importance for the Study of Dynamics by Field-Induced Residual Dipolar Couplings. J. Am. Chem. Soc. 126, 10820-10821 (2004). PDF. |
| 25. |
E. O'Neil-Cabello, D.L. Bryce,
E.P. Nikonowicz, and A. Bax Measurement of five dipolar couplings from a single 3D NMR multiplet applied to the study of RNA dynamics. J. Am. Chem. Soc. 126, 66-67 (2004). PDF.  Download pdb file for the NMR structure of stem region of helix-35 of 23S E.coli ribosomal RNA: 2GBH.pdb |
| 24. |
D.L. Bryce and A. Bax Application of correlated residual dipolar couplings to the determination of the molecular alignment tensor magnitude of oriented proteins and nucleic acids. J. Biomol. NMR 28, 273-287 (2004). PDF. Faculty of 1000 "Recommended" |
| 23. |
David L. Bryce, Klaus Eichele,
and Roderick E. Wasylishen An 17O NMR and Quantum Chemical Study of Monoclinic and Orthorhombic Polymorphs of Triphenylphosphine Oxide Inorg. Chem. 42, 5085-5096 (2003). PDF. |
| 22. |
David L. Bryce and Roderick E.
Wasylishen Microwave Spectroscopy and Nuclear Magnetic Resonance Spectroscopy - What is the Connection? Acc. Chem. Res. 36, 327-334 (2003). PDF. Cover article.  |
| 21. |
Michelle A. M. Forgeron, David
L. Bryce, Roderick E. Wasylishen,
and Roland Roesler A Solid-State Multinuclear Magnetic Resonance Investigation of Hexamethylborazine J. Phys. Chem. A 107, 726-735 (2003). PDF. |
| 20. |
David L. Bryce and Roderick E.
Wasylishen Evaluation of the Influence of Anisotropic Indirect Nuclear Spin-Spin Coupling Tensors on Effective Residual Dipolar Couplings for Model Peptides J. Biomol. NMR 25, 73-78 (2003). PDF. |
| 19. |
Roderick E. Wasylishen and David
L. Bryce A Revised Experimental Absolute Magnetic Shielding Scale for Oxygen J. Chem. Phys. 117, 10061-10066 (2002). PDF. |
| 18. |
Juha Vaara, Jukka Jokisaari,
Roderick E. Wasylishen, and David L.
Bryce Spin-Spin Coupling Tensors as Determined by Experiment and Computational Chemistry Prog. Nucl. Magn. Reson. Spectrosc. 41, 233-304 (2002). PDF. |
| 17. |
David L. Bryce and Roderick E.
Wasylishen A 95Mo and 13C Solid-State NMR and Relativistic DFT Investigation of Mesitylenetricarbonylmolybdenum(0) - A Typical Transition Metal Piano-Stool Complex Phys. Chem. Chem. Phys. 4, 3591-3600 (2002). PDF. |
| 16. |
David L. Bryce and Roderick E.
Wasylishen Insight into the Structure of Silver Cyanide from 13C and 15N Solid-State NMR Spectroscopy Inorg. Chem. 41, 4131-4138 (2002). PDF. |
| 15. |
David L. Bryce and Roderick E.
Wasylishen Interpretation of Indirect Nuclear Spin-Spin Coupling Tensors for Polyatomic Xenon Fluorides and Group 17 Fluorides: Results from Relativistic Density Functional Calculations Inorg. Chem. 41, 3091-3101 (2002). PDF. |
| 14. |
David L. Bryce, Roderick E.
Wasylishen, Jochen Autschbach, and Tom
Ziegler Periodic Trends in Indirect Nuclear Spin-Spin Coupling Tensors: Relativistic Density Functional Calculations for Interhalogen Diatomics J. Am. Chem. Soc. 124, 4894-4900 (2002). PDF. |
| 13. |
David L. Bryce and Roderick E.
Wasylishen Ab Initio Characterization of Through-Space Indirect Nuclear Spin-Spin Coupling Tensors for Fluorine-X (X=F,C,H) Spin Pairs J. Mol. Struct. 602-603, 463-472 (2002). PDF. Special issue; invited contribution. |
| 12. |
David L. Bryce, Guy M. Bernard,
Myrlene Gee, Michael D.
Lumsden, Klaus Eichele, and Roderick E. Wasylishen Practical Aspects of Modern Routine Solid-State Multinuclear Magnetic Resonance Spectroscopy: One-Dimensional Experiments Can. J. Anal. Sci. Spect. 46, 46-82 (2001). PDF. Invited contribution. |
| 11. |
David L. Bryce and Roderick E.
Wasylishen The First Chromium-53 Solid-State Nuclear Magnetic Resonance Spectra of Diamagnetic Chromium(0) and Chromium(VI) Compounds Phys. Chem. Chem. Phys. 3, 5154-5157 (2001). PDF. |
| 10. |
David L. Bryce, Myrlene Gee, and
Roderick E. Wasylishen High-Field Chlorine NMR Spectroscopy of Solid Organic Hydrochloride Salts: A Sensitive Probe of Hydrogen Bonding Environment J. Phys. Chem. A 105, 10413-10421 (2001). PDF. |
| 9. |
David L. Bryce and Roderick E.
Wasylishen Modeling 2h Jiso(N, N) in Nucleic Acid Base Pairs: Ab Initio Characterization of the 2h J(N, N) Tensor in the Methyleneimine Dimer as a Function of Hydrogen Bond Geometry J. Biomol. NMR 19, 371-375 (2001). PDF. |
| 8. |
David L. Bryce, Roderick E.
Wasylishen, and Myrlene Gee Characterization of Tricoordinate Boron Chemical Shift Tensors: Definitive High-Field Solid-State NMR Evidence for Anisotropic Boron Shielding J. Phys. Chem. A 105, 3633-3640 (2001). PDF. |
| 7. |
David L. Bryce and Roderick E.
Wasylishen Ab Initio Calculations of NMR Parameters For Diatomic Molecules: An Exercise In Computational Chemistry J. Chem. Educ. 78, 124-133 (2001). PDF. |
| 6. |
David L. Bryce and Roderick E.
Wasylishen Symmetry Properties of Indirect Nuclear Spin-Spin Coupling Tensors: First Principles Results for ClF3 and OF2 J. Am. Chem. Soc. 122, 11236-11237 (2000). PDF. |
| 5. |
Roderick E. Wasylishen, David L.
Bryce, Corey J. Evans, and Michael
C. L. Gerry Hyperfine Structure in the Rotational Spectrum of GaF. A Comparison of Experimental and Calculated Spin-Rotation and Electric Field Gradient Tensors J. Mol. Spectrosc. 204, 184-194 (2000). PDF. |
| 4. |
David L. Bryce and Roderick E.
Wasylishen Dipolar-Chemical Shift and Rotational Resonance 13C NMR Studies of the Carboxyl-Methylene Spin Pair in Solid Phenylacetic Acid and Potassium Hydrogen Bisphenylacetate J. Phys. Chem. A 104, 7700-7710 (2000). PDF. |
| 3. |
David L. Bryce and Roderick E.
Wasylishen Indirect Nuclear Spin-Spin Coupling Tensors in Diatomic Molecules: A Comparison of Results Obtained by Experiment and First Principles Calculations J. Am. Chem. Soc. 122, 3197-3205 (2000). PDF. |
| 2. |
David L. Bryce and Roderick E.
Wasylishen Rotational Resonance in Solid State NMR Encyclopedia of Spectroscopy and Spectrometry (Lindon, J. C., Tranter, G. E.; Holmes, J. L., eds.) Academic Press Ltd.; 2000, pp 2136-2144. PDF. Iinvited contribution. |
| 1. |
David L. Bryce and Roderick. E.
Wasylishen Beryllium-9 NMR Study of Solid Bis(2,4-pentanedionato-O,O')beryllium and Theoretical Studies of 9Be Electric Field Gradient and Chemical Shielding Tensors. The First Evidence for Anisotropic Beryllium Shielding J. Phys. Chem. A 103, 7364-7372 (1999). PDF. |