QuadFit—A new cross-platform computer program for simulation of NMR line shapes from solids with distributions of interaction parameters
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MacKenzie, 2002
Engelhardt, 1987
Schmidt-Rohr, 1996
D. Massiot, H. Thiele, A. Germanus, WinFit, Bruker Report 140 (1994), p. 43.
H.K. Jakobsen, STARS Package, Aarhus University, Denmark, Varian: Palo Alto, CA.
K. Eichele, R.E. Wasylishen, WSolids NMR Simulation Package (2001). URL 〈http://ramsey.chem.ualberta.ca/software/software.html〉.
Amoureux, 1990, NATO ASI Series C, 322, 409
J.P. Amoureux, C. Fernandez, QUASAR Solid-State NMR Simulation for Quadrupolar Nuclei, University of Lille, France.
Hoatson, 2002, 93Nb MAS NMR study if perovskite relaxor ferroelectrics, Physical Review B, 66, 224103, 10.1103/PhysRevB.66.224103
Massiot, 2002, Modelling one- and two-dimensional solid-state NMR spectra, Magnetic Resonance in Chemistry, 40, 70, 10.1002/mrc.984
D. Massiot, dmfit program, available at 〈http://crmht-europe.cnrsorleans.fr〉.
Press, 1997
Kohn, 1989, A multinuclear magnetic resonance study of the structure of hydrous albite glasses, Geochimica et Cosmochimica Acta, 53, 2925, 10.1016/0016-7037(89)90169-5
Kohn, 1998, Sodium environments in dry and hydrous albite glasses. Improved 23Na solid state NMR data and their implications for water dissolution mechanisms, Geochimica et Cosmochimica Acta, 62, 79, 10.1016/S0016-7037(97)00318-9
Toplis, 2000, Fivefold-coordinated aluminium in tectosilicate glasses observed by triple quantum MAS NMR, American Mineralogist, 85, 1556, 10.2138/am-2000-1031
Neuville, 2007, Local Al site distribution in aluminosilicate glasses, Journal of Non-Crystalline Solids, 353, 180, 10.1016/j.jnoncrysol.2006.09.035
MacKenzie, 2007, Crystalline aluminium borates with the mullite structure: A 11B and 27Al solid-state NMR study, Applied Magnetic Resonance, 32, 647, 10.1007/s00723-007-0044-x
Alderman, 1986, Methods for analysing spectroscopic line shapes. NMR solid powder patterns, Journal of Chemical Physics, 84, 3717, 10.1063/1.450211
Czjzek, 1981, Atomic coordination and the distribution of electric field gradients in amorphous solids, Physical Review B, 23, 2513, 10.1103/PhysRevB.23.2513
Czjzek, 1982, Distribution of nuclear quadrupole splitting of 57Fe in amorphous ferric fluorides: structural implications, Physical Review B, 25, 4908, 10.1103/PhysRevB.25.4908
Poplett, 1998, Field sweep broadline NMR spectroscopy, Solid State NMR, 11, 211, 10.1016/S0926-2040(97)00110-0
Holland, 2007, Boron-10 NMR: what extra information can it give about borate glasses, Physics and Chemistry of Glasses: European Journal of Glass Science and Technology, 48B, 1
Jellison, 1977, NMR powder patterns for integer spin nuclei in the presence of asymmetric quadrupolar effects, Journal of Magnetic Resonance, 27, 121, 10.1016/0022-2364(77)90198-6
K. Eichele, Private communication.