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physics, atomic, molecular & chemical (4) 4
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fluorination (3) 3
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Materials Chemistry and Physics, ISSN 0254-0584, 02/2019, Volume 223, pp. 715 - 722
The structural characterization of fluorinated zigzag (4,0), (6,0), (8,0) and (10,0) single walled carbon nanotubes (F-SWCNT) has been investigated... 
Isotropic and anisotropic chemical shifts | Fluorination | GIPAW | SWCNT
Journal Article
Materials Chemistry and Physics, ISSN 0254-0584, 02/2019, Volume 223, p. 715
The structural characterization of fluorinated zigzag (4,0), (6,0), (8,0) and (10,0) single walled carbon nanotubes (F-SWCNT) has been investigated... 
Organic chemistry | Chemical equilibrium | Parameters | Dependence | NMR spectroscopy | Fluorination | Carbon 13 | Functional groups | Single wall carbon nanotubes | Structural analysis
Journal Article
Chemical Physics Letters, ISSN 0009-2614, 01/2019, Volume 715, pp. 310 - 316
[Display omitted] •Fluorination leads interesting variations in the first and second order optical responses in Lithium substituted Adamantane.•The fluorinated... 
Adamanatne | Non linear responses | TDDFT | Hyperpolarizability | NUMBER | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | DIAMONDOIDS | SALT | PYRIDAZINE LI-H3C4N2 | PERFLUOROADAMANTANE | NONLINEAR-OPTICAL PROPERTIES | THEORETICAL FRAMEWORK
Journal Article
Journal of Biomolecular Structure and Dynamics, ISSN 0739-1102, 02/2010, Volume 27, Issue 4, pp. 561 - 572
There has been much recent progress in using NMR chemical shift anisotropy (CSA) parameters to gain information about secondary structure content in proteins.... 
TENSORS | CROSS-CORRELATED RELAXATION | C-13 | BIOPHYSICS | SOLID-STATE NMR | ORIENTATION | BIOCHEMISTRY & MOLECULAR BIOLOGY | AB-INITIO | C-ALPHA | ANTIMICROBIAL PEPTIDE | EMPIRICAL CORRELATION | DIPOLAR | Proteins - chemistry | Protein Structure, Secondary | Anisotropy | Nuclear Magnetic Resonance, Biomolecular - methods | Nitrogen Isotopes
Journal Article
Physical Review A - Atomic, Molecular, and Optical Physics, ISSN 1050-2947, 01/2012, Volume 85, Issue 1
Journal Article
Chemical Physics Letters, ISSN 0009-2614, 2010, Volume 489, Issue 4, pp. 248 - 253
The 19F CSA tensor can be estimated from the CSA-DD cross-correlated spin relaxation rate which shows up as a differential relaxation of the transitions in the... 
Journal Article
Chemical Physics Letters, ISSN 0009-2614, 03/2020, Volume 742, p. 137142
[Display omitted] •The pattern and percentage of fluorination influence on the 13C and 19F NMR parameters.•19F NMR parameters differentiate the degree and... 
Band structure | Chemical shift parameters | Density of states | Fluorination | SWCNT | WALL CARBON NANOTUBES | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | GENERALIZED GRADIENT APPROXIMATION | DEPENDENCE | DEFLUORINATION | DIAMETER | CONDUCTIVITY | SURFACE | CHEMISTRY | SIDEWALL FUNCTIONALIZATION | C-13 NMR
Journal Article
Chemical Physics Letters, ISSN 0009-2614, 04/2010, Volume 489, Issue 4-6, pp. 248 - 253
Journal Article
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