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A 11B and 31P MAS NMR study of the impact of Ca2+ and Sr2+ network modifying cations on the structure of borate and borophosphate glasses
Download2018-01-01
Jin, T., Bernard, G.M., Miskolzie, M., Terskikh, V.V., Michaelis, V.K.
A detailed qualitative and quantitative analysis of the short and medium range order of alkaline earth binary borate and ternary borophosphate glasses has been carried out through the use of 11B and 31P magic angle spinning nuclear magnetic resonance (MAS NMR) spectroscopy. In order to understand...
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Alkaline Earth Metal–Organic Frameworks with Tailorable Ion Release: A Path for Supporting Biomineralization
Download2019-01-01
Matlinska, M.A., Ha, M., Hughton, B., Oliynyk, A.O., Iyer, A.K., Bernard, G.M., Lambkin, G., Lawrence, M.C., Katz, M.J., Mar, A., Michaelis, V.K.
An innovative application of metal–organic frameworks (MOFs) is in biomedical materials. To treat bone demineralization, which is a hallmark of osteoporosis, biocompatible MOFs (bioMOFs) have been proposed in which various components, such as alkaline-earth cations and bisphosphonate molecules,...
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Annealing induced structural evolution in feldspar dental glass-ceramics investigated by solid-state NMR spectroscopy
Download2020-01-01
Bhattacharya, A., Qiu, Y., Bernard, G.M., Butler, S., Mar, A., Michaelis, V.K.
Glass-ceramics are an attractive oxide-based material routinely used for biomineral repair such as porcelain veneers in dental crown applications. The short- and long-range structure of a commercial glass-ceramic feldspar material, VITA VM9, has been investigated as a function of annealing...
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Composition-Tunable Formamidinium Lead Mixed Halide Perovskites via Solvent-Free Mechanochemical Synthesis: Decoding the Pb Environments Using Solid-State NMR Spectroscopy
Download2018-01-01
Askar, A.M., Karmakar, A., Bernard, G.M., Ha, M., Terskikh, V.V., Wiltshire, B.D., Patel, S., Fleet, J., Shankar, K., Michaelis, V.K.
Mixed-halide lead perovskites are becoming of paramount interest in the optoelectronic and photovoltaic research fields, offering band gap tunability, improved efficiency, and enhanced stability compared to their single halide counterparts. Formamidinium-based mixed halide perovskites (FA-MHPs)...
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2019-01-01
Bernard, G.M., Michaelis, V.K.
High‐field dynamic nuclear polarization nuclear magnetic resonance (DNP NMR) spectroscopy is rapidly emerging as a revolutionary analytical structural method by greatly enhancing the sensitivity of nuclear magnetic resonance. Innovative solutions are constantly being introduced to address the...
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Lead‐207 NMR spectroscopy at 1.4 T: Application of benchtop instrumentation to a challenging I = ½ nucleus
Download2020-01-01
Bernard, G.M., Michaelis, V.K.
The practicality of obtaining liquid‐ and solid‐state 207Pb nuclear magnetic resonance (NMR) spectra with a low permanent‐field magnet is investigated. Obtaining 207Pb NMR spectra of salts in solution is shown to be viable for samples as dilute as 0.05 M. The concentration dependence of the 207Pb...
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Mechanochemical Synthesis of Methylammonium Lead Mixed–Halide Perovskites: Unraveling the Solid-Solution Behavior Using Solid-State NMR
Download2018-01-01
Karmakar, A., Askar, A.M., Bernard, G.M., Terskikh, V.V., Ha, M., Patel, S., Shankar, K., Michaelis, V.K.
Mixed-halide lead perovskite (MHP) materials are rapidly advancing as next-generation high-efficiency perovskite solar cells due to enhanced stability and bandgap tunability. In this work, we demonstrate the ability to readily and stoichiometrically tune the halide composition in...
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2017-01-01
Bernard, G.M., Goyal, A., Miskolzie, M., McKay, R., Wu, Q., Wasylishen, R.E., Michaelis, V.K.
A new solid-state nuclear magnetic resonance (NMR) thermometry sample is proposed. The 207Pb NMR chemical shift of a lead halide perovskite, methylammonium lead chloride (MAPbCl3) is very sensitive to temperature, 0.905 ± 0.010 ppm K−1. The response to temperature is linear over a wide...
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Phase Evolution in Methylammonium Tin Halide Perovskites with Variable Temperature Solid-State 119Sn NMR Spectroscopy
Download2020-01-01
Ha, M., Karmakar, A., Bernard, G.M., Basilio, E., Krishnamurthy, A., Askar, A.M., Shankar, K., Kroeker, S., Michaelis, V.K.
Hybrid organic–inorganic metal-halide perovskite materials are an emerging class of materials that could profoundly change the optoelectronic and solar absorber research fields and have far-reaching applications. Unfortunately, the leading solar-absorbing candidates are lead-containing materials...
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Tailorable Indirect to Direct Band-Gap Double Perovskites with Bright White-Light Emission: Decoding Chemical Structure Using Solid-State NMR
Download2020-01-01
Karmakar, A., Bernard, G.M., Meldrum, A., Oliynyk, A.O., Michaelis, V.K.
Efficient white-light-emitting single-material sources are ideal for sustainable lighting applications. Though layered hybrid lead–halide perovskite materials have demonstrated attractive broad-band white-light emission properties, they pose a serious long-term environmental and health risk as...