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10.1021/acs.jpcb.6b05755 http://scihub22266oqcxt.onion/10.1021/acs.jpcb.6b05755 C5418864!5418864!27454747     free     free     free Deprecated: Implicit conversion from float 209.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Warning: imagejpeg(C:\Inetpub\vhosts\kidney.de\httpdocs\phplern\27454747.jpg): Failed to open stream: No such file or directory in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 117       J+Phys+Chem+B 2016 ; 120 (32): 7851-8 Nephropedia Template TP {{tp|p=27454747|t=2016. 17O NMR Investigation of Water Structure and Dynamics |pdf=|usr=}}{{27454747}} gab.com Text 17O NMR Investigation of Water Structure and Dynamics JO: J Phys Chem B http://www.kidney.de/pget.php?&tw=1&pmid=27454747 #FOAvip The structure and dynamics of the bound water in barium chlorate monohydrate were studied with 17O nuclear magnetic resonance (NMR) spectroscopy in samples that are stationary and spinning at the magic-angle in magnetic fields ranging from 14.1 to 21.1 T. 17O NMR parameters of the water were determined, and the effects of torsional oscillations of the water molecule on the 17O quadrupolar coupling constant (CQ) were delineated with variable temperature MAS NMR. With decreasing temperature and reduction of the librational motion, we observe an increase in the experimentally measured CQ explaining the discrepancy between experiments and predictions from density functional theory. In addition, at low temperatures and in the absence of 1H decoupling, we observe a well-resolved 1H?17O dipole splitting in the spectra, which provides information on the structure of the H2O molecule. The splitting arises because of the homogeneous nature of the coupling between the two 1H?17O dipoles and the 1H?1H dipole. Twit Text FOAVip 17O NMR Investigation of Water Structure and Dynamics ????J Phys Chem B http://www.kidney.de/pget.php?&tw=1&pmid=27454747 #FOAvip Twit Text # Free Paper on # # # # # LINK http://www.kidney.de/pget.php?&tw=1&pmid=27454747 #FOAvip English Wikipedia <ref>{{Cite pmid|27454747}}</ref> 17O NMR Investigation of Water Structure and Dynamics #MMPMID27454747 Keeler EG; Michaelis VK; Griffin RG J Phys Chem B 2016[Aug]; 120 (32): 7851-8 PMID27454747show ga The structure and dynamics of the bound water in barium chlorate monohydrate were studied with 17O nuclear magnetic resonance (NMR) spectroscopy in samples that are stationary and spinning at the magic-angle in magnetic fields ranging from 14.1 to 21.1 T. 17O NMR parameters of the water were determined, and the effects of torsional oscillations of the water molecule on the 17O quadrupolar coupling constant (CQ) were delineated with variable temperature MAS NMR. With decreasing temperature and reduction of the librational motion, we observe an increase in the experimentally measured CQ explaining the discrepancy between experiments and predictions from density functional theory. In addition, at low temperatures and in the absence of 1H decoupling, we observe a well-resolved 1H?17O dipole splitting in the spectra, which provides information on the structure of the H2O molecule. The splitting arises because of the homogeneous nature of the coupling between the two 1H?17O dipoles and the 1H?1H dipole. ä17O NMR Investigation of Water Structure and Dynamics (epmc).pdf DeepDyve Pubget Overpricing