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1Author    S. Lewicki, B. Szafrańska, Z. PająkRequires cookie*
 Title    Molecular Motion in Solid Tetrapropylammonium Bromide and Iodide  
 Abstract    The proton NMR second moment and spin-lattice relaxation time for tetrapropylammonium bromide and iodide have been measured over a wide temperature range. A solid-solid phase transition related to the onset of cation tumbling was found for both salts and confirmed by DTA. In the low temperature phases methyl group reorientation was evidenced. For iodide a dynamic nonequivalence of the methyl groups and the onset of ethyl groups motion was also discovered. 
  Reference    Z. Naturforsch. 47a, 1115—1118 (1992); received July 14 1992 
  Published    1992 
  Keywords    NMR, Molecular motions, Phase transitions 
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 TEI-XML for    default:Reihe_A/47/ZNA-1992-47a-1115.pdf 
 Identifier    ZNA-1992-47a-1115 
 Volume    47 
2Author    B. C. Sanctuary, M. Angala, S. K. Rish, N. AnRequires cookie*
 Title    Theory of NQR Pulses  
 Abstract    Pulses applied to spin systems with I > 1/2 in the absence of any external fields, the NQR case, are fundamentally different from NMR pulses. In particular, both rotating and counter-rotating components of the rf field must be kept in NQR, whereas only the "in phase" component need be retained in NMR. NQR pulses are illustrated for 7 = 3 / 2 in an axially symmetric electric field gradient (EFG). 
  Reference    Z. Naturforsch. 49a, 71—7 (1994); received October 27 1993 
  Published    1994 
  Keywords    NQR, Pulse, Density matrix, NMR 
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 TEI-XML for    default:Reihe_A/49/ZNA-1994-49a-0071.pdf 
 Identifier    ZNA-1994-49a-0071 
 Volume    49 
3Author    Barbara Szafrańska, Zdzisław PająkRequires cookie*
 Title     
 Abstract    o le c u la r M o tio n in S o lid T e tr a e th y l-a n d T e tra p ro p y la m m o n iu m T e tr a f lu o r o b o r a te s Proton and fluorine NMR second moments and spin-lattice relaxation times for polycrystalline tetraethyl-and tetrapropylammonium tetrafluoroborates have been measured over a wide range of temperatures. Solid-solid phase transitions were found for both compounds and confirmed by DSC. Methyl group C3 reorientation followed by more complex cation motions was evidenced in the low temperature phases. Overall cation reorientation characterises the high temperature phases of both compounds. Isotropic anion reorientation was found in both salts in both phases. 
  Reference    Z. Naturforsch. 50a, 584—588 (1995); received August 15 1994 
  Published    1995 
  Keywords    NMR, Molecular motions, Phase transitions 
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 TEI-XML for    default:Reihe_A/50/ZNA-1995-50a-0584.pdf 
 Identifier    ZNA-1995-50a-0584 
 Volume    50 
4Author    M. Grottel3, A. Kozakb, Z. PająkRequires cookie*
 Title    l H a n  
 Abstract    d 19F N M R S tu d y o f C a tio n a n d A n io n M o tio n s in G u a n id in iu m F lu o r o a n tim o n a te s Proton and fluorine NMR linewidths, second moments, and spin-lattice relaxation times of polycrystalline [C(NH2)3]2SbF5 and C(NH2)3SbF6 were studied in a wide temperature range. For the pentafluoroantimonate, C3-reorientation of the guanidinium cation and C4-reorientation of the SbF5 anion were revealed and their activation parameters determined. The dynamical inequivalence of the two guanidinium cations was evidenced. For the hexafluoroantimonate, two solid-solid phase transitions were found. In the low temperature phase the guanidinium cation undergoes C3 reorien­ tation while the SbF6 anion reorients isotropically. The respective activation parameters were derived. At high temperatures new ionic plastic phases were evidenced. 
  Reference    Z. Naturforsch. 50a, 742—748 (1995); received March 2 1995 
  Published    1995 
  Keywords    NMR, Molecular Motions, Phase transitions 
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 TEI-XML for    default:Reihe_A/50/ZNA-1995-50a-0742.pdf 
 Identifier    ZNA-1995-50a-0742 
 Volume    50 
5Author    M. Grottel, M. Szafrański, Z. PająkRequires cookie*
 Title    NMR Study of Cation Motion in Guanidinium Iodoplumbates  
 Abstract    Proton NMR second moments and spin-lattice relaxation times of polycrystalline C(NH 2) 3 PbI 3 and [C(NH 2) 3 ]2PbI 4 were studied in a wide temperature range. The order-disorder character of the existing solid-solid phase transitions was confirmed and for tetraiodoplumbate a new phase transition at 170 K was discovered. For both compounds a dynamical inequivalence and unusual high mobility of the guanidinium cations were revealed. For the reorientations discovered (NH 2 group flipping, C 3 in-plane reorientation and a tumbling) the activation parameters were determined. 
  Reference    Z. Naturforsch. 52a, 783—788 (1997); received October 6 1997 
  Published    1997 
  Keywords    NMR, Molecular Motions, Phase Transitions 
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 TEI-XML for    default:Reihe_A/52/ZNA-1997-52a-0783.pdf 
 Identifier    ZNA-1997-52a-0783 
 Volume    52 
6Author    PhilipJ. Bray, GaryL. PetersenRequires cookie*
 Title    NMR and NQR Studies of Borate Glasses  
 Abstract    Nuclear magnetic resonance (NMR) has been used for some 40 years to study atomic arrange-ments, chemical bonding, and structural groupings in borate glasses and crystalline compounds, and nuclear quadrupole resonance (NQR) has more recently increased the resolution and accuracy of the measurements. Examples are presented of the use of first-order and second-order quadrupo-lar effects in "B NMR spectra to obtain structural information, and n B and 10 B NQR spectra to obtain the quadrupolar parameters Q cc (the coupling constant) and 77 (the asymmetry parameter) with accuracies of 5 or 6 significant figures, and 3 figures, respectively. Q cc and 77 are extremely sensitive to changes in atomic rearrangements and chemical bonds, so they are excellent monitors and provide identification of bonding configurations and structural groupings in borates: Examples are also presented in which combinations of NMR and NQR data are used to extract the desired information. NQR detection of resonances at frequencies as low as 276 kHz is discussed. 
  Reference    Z. Naturforsch. 53a, 273—284 (1998); received December 30 1997 
  Published    1998 
  Keywords    NMR, NQR, Borates, Quadrupolar Interactions 
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 TEI-XML for    default:Reihe_A/53/ZNA-1998-53a-0273.pdf 
 Identifier    ZNA-1998-53a-0273 
 Volume    53 
7Author    Maria Zdanowska-Fnjczek, Malgorzata Grottel, Ryszard JakubasRequires cookie*
 Title    C1 NQR and l H NMR Studies of Molecular Motions in Guanidinium Salt of Chloroacetic Acid  
 Abstract    Multinuclear NQR and NMR techniques have been applied in order to study the molecular dynamics in [C(NH 2) 3 ](ClH 2 CCOO). The 35 C1 NQR frequency was measured over a wide range of temperature. The experimental results were described by using the theories of Bayer and Brown which take into account the torsional oscillations of the CClH 2 -group of the anion. A study of the proton NMR second moment as well as relaxation times T, and T Xp performed in a wide temperature range revealed an onset of the guanidinium cation reorientation around its two-fold symmetry axis. Activation parameters for this motion were determined. 
  Reference    Z. Naturforsch. 53a, 484—487 (1998); received March 24 1998 
  Published    1998 
  Keywords    NMR, NQR, Molecular Motion 
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 TEI-XML for    default:Reihe_A/53/ZNA-1998-53a-0484.pdf 
 Identifier    ZNA-1998-53a-0484 
 Volume    53 
8Author    A. Pajzderska, J. Wąsicki, S. LewickiRequires cookie*
 Title    Molecular Motion in Tetraphenyltin Studied by NMR  
 Abstract    NMR second moment and spin-lattice relaxation times in the laboratory (60 and 25 MHz) and in the rotating frame (B { = 2.1 mT) were studied for polycrystalline tetraphenyltin Sn(C 6 H 5) 4 in a wide tem-perature range. Two kinds of motions were detected: isotropic rotation of whole molecules and reorien-tations/oscillations of phenyl rings. A dependence of the potential energy of the molecule in the crystal on the angle of the phenyl ring rotation about the Sn-C bond was obtained on the basis of atom-atom calculations. The amplitude of the ring-oscillations at 133 K was estimated as ± 7°. Below room tem-perature the magnetisation recovery is significantly non-exponential, which may be interpreted as due to the correlated motion of phenyl rings. 
  Reference    Z. Naturforsch. 54a, 488—494 (1999); received June 7 1999 
  Published    1999 
  Keywords    NMR, Relaxation, Potential Energy 
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 TEI-XML for    default:Reihe_A/54/ZNA-1999-54a-0488.pdf 
 Identifier    ZNA-1999-54a-0488 
 Volume    54 
9Author    T. J. BastowRequires cookie*
 Title    47,49jj NMR in Metals, Inorganics, and Gels  
 Abstract    Some recent progress in solid state 47,49 Ti NMR is described and reviewed. The metallic-state work described covers metals such as hep titanium, TiB 2 , a number of intermetallics such as TiAl 2 and TiAl 3 . The inorganic work covers the various titanium oxide based materials including the Ti0 2 polymorphs, anatase, rutile and brookite. The gel work covers the evolution of crystalline titania from gels formed by hydrolysis of titanium isopropoxide. Some complementary data from 17 0 and 13 C NMR and powder X-ray diffraction is also included. 
  Reference    Z. Naturforsch. 55a, 291—297 (2000); received September 11 1999 
  Published    2000 
  Keywords    Titanium, NMR, Metals, Oxides, Gels 
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 TEI-XML for    default:Reihe_A/55/ZNA-2000-55a-0291.pdf 
 Identifier    ZNA-2000-55a-0291 
 Volume    55 
10Author    Liuping Chen, Thomas Gross, Hans-Dietrich LüdemannRequires cookie*
 Title    The T, /7-Dependence of the Chemical Shift of the Hydroxyl Protons in Deeply Supercooled Methanol and Water  
 Abstract    The hydroxyl proton chemical shifts 6 (H-O) of supercooled methanol (7" min = 149 K) and water have been determined (7" min = 183 K), and the pressure dependence of these shifts was measured up to 200 MPa. In both compounds the downfield shift of <5 (H-O) continues down to the lowest tempera-tures reached. This result disagrees with the two state models for the hydrogen bond formation in both liquids. The isotherms ö (H 2 0) show for T< 273 K an upfield shift that becomes more pronounced with decreasing temperature. For 6 (H-O-CH^), increasingp causes at all temperatures a downshift. 
  Reference    Z. Naturforsch. 55a, 473—477 (2000); received November 11 1999 
  Published    2000 
  Keywords    NMR, Supercooling, Pressure, Methanol, Water 
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 TEI-XML for    default:Reihe_A/55/ZNA-2000-55a-0473.pdf 
 Identifier    ZNA-2000-55a-0473 
 Volume    55 
11Author    J. Wąsicki, Z. Pająk, A. KozakRequires cookie*
 Title    Cation and Anion Reorientation at Phase Transition in Pyridinium Tetrafluoroborate  
 Abstract    Temperature dependences of and 19 F second moment and spin-lattice relaxation times for polycrystalline pyridinium tetrafluoroborate were measured. A phase transition was discovered at 202 K. A model of cation reorientation between inequivalent (low-temperature phase) and equiva-lent (high-temperature phase) equilibrium positions is proposed. Whether the anion reorients isotropically or about a symmetry axis cannot be decided. An analysis of cross-relaxation effects yielded activation parameters for cation and anion reorientation. The rotational correlation times for both ions converge just at the phase transition reaching the value of 10~ 10 s. 
  Reference    Z. Naturforsch. 45a, 33—36 (1990); received August 5 1989 
  Published    1990 
  Keywords    NMR, cross-relaxation, molecular motions, phase transitions 
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 TEI-XML for    default:Reihe_A/45/ZNA-1990-45a-0033.pdf 
 Identifier    ZNA-1990-45a-0033 
 Volume    45 
12Author    W. W. Warren, R. E. WalstedtRequires cookie*
 Title    NQR and NMR Studies of Spin Dynamics in High T c Superconducting Cuprates  
 Abstract    Recent NQR and NMR studies of Cu spin dynamics in metallic YBa 2 Cu 3 0 6+JC are reviewed. The Cu nuclear relaxation rates are shown to be inconsistent with weak correlation (band) theory and the Korringa relation, but the Cu spins retain important characteristics of itinerancy. These include pairing of the Cu d-spins in the superconducting state and strong sensitivity of the Cu spin dynamics to changes in carrier concentration associated with variation of the oxygen content. Samples of reduced oxygen content (T c = 60 K) are found to contain a high concentration of Cu + Cu(l) sites associated with "full chain-empty chain" vacancy ordering. These samples also exhibit remarkable precursive suppression of planar Cu(2) nuclear relaxation above T c . 
  Reference    Z. Naturforsch. 45a, 385—392 (1990); received October 25 1989 
  Published    1990 
  Keywords    NMR, NQR, Nuclear relaxation, Spin fluctuations, Superconductivity 
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 TEI-XML for    default:Reihe_A/45/ZNA-1990-45a-0385.pdf 
 Identifier    ZNA-1990-45a-0385 
 Volume    45 
13Author    H. Nishihara, K. Hayashi, M. Naito, T. Butz, A. Lerf, S. SaibeneRequires cookie*
 Title    NQR and Low-Field NMR of 181 Ta in the Low-Temperature CDW State of 2 H-TaS 2  
 Abstract    NQR and low-field NMR spectra of 18I Ta are reported to probe the electronic environment of inequivalent tantalum sites in the low-temperature CDW state of a layered compound 2 H-TaS 2 . The overall features are found to be consistent with the structure consisting of nine-atom snowflake clusters in a locally commensurate CDW state. 
  Reference    Z. Naturforsch. 45a, 412—414 (1990); received August 23 1989 
  Published    1990 
  Keywords    NQR, NMR, 181 Ta, CDW, TaS 2 
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 TEI-XML for    default:Reihe_A/45/ZNA-1990-45a-0412.pdf 
 Identifier    ZNA-1990-45a-0412 
 Volume    45 
14Author    Z. Szafrańska, A. Pająk, KozakRequires cookie*
 Title     
 Abstract    Proton and fluorine NMR second moments and spin-lattice relaxation times for polycrystalline tetrabutylammonium tetrafluoroborate have been measured over a wide range of temperatures at several Larmor frequencies. An analysis of cross-relaxation effects results in a determination of activation parameters for anion and cation reorientations. Three solid phases characterized by different ion dynamics are evidenced. M o le c u la r M o tio n in S o lid T e tra b u ty la m m o n iu m T e tr a f lu o r o b o r a te 
  Reference    Z. Naturforsch. 46a, 545—550 (1991); received March 14 1991 
  Published    1991 
  Keywords    NMR, Cross-relaxation, Molecular motions, Phase transitions 
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 TEI-XML for    default:Reihe_A/46/ZNA-1991-46a-0545.pdf 
 Identifier    ZNA-1991-46a-0545 
 Volume    46 
15Author    Silvia Wigand, Tetsuo Asaji, Ryuichi Ikeda, Daiyu NakamuraRequires cookie*
 Title    Reorientational Motion of Trihalogenomethyl Groups in Organic Compounds as Studied by 35 C1 NQR and 19 F NMR Spectroscopy  
 Abstract    Trihalogenomethyl derivatives of 4-chloroacetanilide, 4-ClC6HfNHCOCCl3,4-ClC6H4NHCOCF2Cl, and 4-ClC6H4NHCOCF3 were prepared. The 35 C1 NQR and 79 F NMR spin-lattice relaxation times T1Q and T1F, respectively, of these compounds were measured at various temperatures. On heating, T1Q of the CC13 and CF2C1 groups decreased rapidly above ca. 110 and 150 K, respectively, showing the onset of reorientation of the trihalogenomethyl group about the pseudo-triad axis. The activa-tion energies were determined to be 27 and 13kJmol _1 for the CC13 and CF2C1 reorientation, respectively. The temperature dependences of the 19 F NMR T1F of the CF2C1 and CF3 groups lead to activation energies of 13 and 4.3 kJ mol~ 1 , respectively, for the same reorientations. T1F of the CF3 group observed above ca. 200 K was attributed to the spin-rotational interaction. The TIQ 1 of ring-chlorine in 4-ClC6H4NHCOCCl3 and 4-ClC6H4NHCOCF3 can be interpreted by the T" law with « = 2.2 and 1.1, respectively, whereas that of 4-ClC6H4NHCOCF2Cl by the sum of two contributions: T" law (n = 2.0) and the modulation mechanism due to the CF2C1 reorientation. 
  Reference    Z. Naturforsch. 47a, 265—273 (1992); received July 19 1991 
  Published    1992 
  Keywords    Spin-lattice relaxation, NQR, NMR, Reorientational motion 
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 TEI-XML for    default:Reihe_A/47/ZNA-1992-47a-0265.pdf 
 Identifier    ZNA-1992-47a-0265 
 Volume    47 
16Author    B.V S Murthy, K. P. Ramesh, J. RamakrishnaRequires cookie*
 Title    Molecular Dynamics in Tetramethyl Ammonium Hexabromo Selenate [N(CH 3 ) 4 ] 2 SeBr 6 . A Proton NMR Study  
 Abstract    spin-lattice relaxation time Ti and second moment M 2 have been studied as a function of tem-perature over the temperature range 445 to 77 K. A discontinuous change in Ti at 365 K, in-dicates the presence of a phase transition, while the slope change at 152 K, is attributed to a change in the TMA ion dynamics from tumbling to torsion. The 7i results could be explained in terms of inequivalent TMA ions and their small angle torsional oscillations. A second moment (M 2) transition occurs around 160 K and is ascribed to the freezing of TMA tumbling and CH 3 reorientation. 
  Reference    Z. Naturforsch. 48a, 868—870 (1993); received February 22 1993 
  Published    1993 
  Keywords    Molecular dynamics, Second moment, NMR, Spin-lattice relaxation time 
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 TEI-XML for    default:Reihe_A/48/ZNA-1993-48a-0868.pdf 
 Identifier    ZNA-1993-48a-0868 
 Volume    48 
17Author    Ho Sung, ChohRequires cookie*
 Title    Magnetic Resonances of 5l V, 209 Bi, Mn 2 + , and Fe 3 + in BiV0 4 Single Crystals  
 Abstract    Nuclear magnetic resonance (NMR) of 51 V and 209 Bi, and electron paramagnetic resonance (EPR) of Mn 2 and Fe 3+ impurities in ferroelastic BiV0 4 single crystals are reviewed. The nuclear quadrupole parameters and principal axes of the two host nuclei, 51 V and 209 Bi, and the second-or-der zero field splitting tensor of the isoelectronic 3d 5 ions, Mn 2 + and Fe 3 + , in Bi V0 4 are determined for the first time. Temperature dependence studies on 51 V NMR and Mn 2+ EPR confirmed that this crystal undergoes a second order phase transition. The substitutional sites of Mn 2+ and Fe 3 + in BiV0 4 are Bi 3 and V 5 + , respectively. 
  Reference    Z. Naturforsch. 51a, 591—602 (1996); received February 3 1996 
  Published    1996 
  Keywords    NMR, EPR, Quadrupole parameters Zero field splittings, Substitutional sites 
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 TEI-XML for    default:Reihe_A/51/ZNA-1996-51a-0591.pdf 
 Identifier    ZNA-1996-51a-0591 
 Volume    51 
18Author    T. A. Babushkina, YuV. Goltyapin, S. I. GushchinRequires cookie*
 Title    I NQR Spectra of Iodobenzoic Acid and Iodophenol Derivatives. H-Bonds and C-I Characteristic Bonds of These Substances  
 Abstract    This is a review of investigations on iodo-benzoic acid, iodohippuric acid, and iodophenol derivatives by NQR, NMR, and emission Mössbauer spectroscopy. The influence of intermolecular, intramolecular, and bifurcated O-H- • I and O-H- • O bonds on the properties of iodine-carbon bonds is demonstrated. Ionized and non-ionized forms of tyrosine differ by the probability of H-bond formation. The simultaneous use of 127 1 NQR and emission Mössbauer 12 T spectroscopy open the possibility to determine the types of tellurium-organic substances formed in the process 
  Reference    Z. Naturforsch. 51a, 651—656 (1996); received October 20 1995 
  Published    1996 
  Keywords    NQR, NMR, iodobenzoic acid, iodohippuric acid, iodophenol 
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 TEI-XML for    default:Reihe_A/51/ZNA-1996-51a-0651.pdf 
 Identifier    ZNA-1996-51a-0651 
 Volume    51 
19Author    Takahiro Ueda, Nobuo NakamuraRequires cookie*
 Title    Sb NMR and SCF-MS-Xa Studies of Quadrupole Interaction and The Electronic Structure of Mixed-Valence Compound, Cs 2 SbCl 6  
 Abstract    Cs 2 SbCl 6 is known as a typical mixed-valence compound. It crystallizes into a tetragonal space group I4 1 /amd and contains two different complex anions, Sb(III)Cl| _ and Sb(V)Clg . The dark blue color of this compound has been considered to originate from a charge transfer between the above two anions. In order to study the electronic structure of these complex anions and the existence of charge transfer between them we measured the 121 Sb NMR spectrum and carried out molecular orbital calculations on the electronic states of these anions. The 121 Sb NMR spectrum consists of two peaks at 0 and 30 kHz which can be assigned to the central transition of l21 Sb in Sb(V)Cl<~ and Sb(III)Cl| _ , respectively. The line shape analyses of the spectra led to nuclear quadrupole coupling constants of nearly zero for Sb(V)Cl7 and 4.9 ±0.5 MHz for Sb(III)Cl| at room temperature. The quadrupole coupling constant of 1 Sb(III) decreases steadily on heating. The calculations of the electronic ground state energies of both anions were calculated by the MS-Xa molecular orbital method. The calculated charge-transfer band from the A lg state of Sb(III)Clg" to the A lg state of Sb(V)Cl6 appears at 610 nm and can account for the experimental electronic spectrum, the calculated quadrupole coupling constant in Sb(III)Clg" however is far larger than the experimental one. The contribution of the charge-transferred state to the ground state is negligible and so the temperature dependence of the quadrupole coupling constant of 121 Sb(III) is attributed to an anisotropic thermal expansion of the compound. 
  Reference    Z. Naturforsch. 51a, 672—676 (1996); received October 10 1995 
  Published    1996 
  Keywords    NMR, Quadrupole interaction, Molecular orbital, Mixed valence 
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 TEI-XML for    default:Reihe_A/51/ZNA-1996-51a-0672.pdf 
 Identifier    ZNA-1996-51a-0672 
 Volume    51 
20Author    K. Ishida, H. Mukuda, Y. Kitaoka, K. Asayama, Y. OnukiRequires cookie*
 Title    Ru NMR and NQR Studies in CeRu 2  
 Abstract    We have carried out Ru NMR and NQR measurements in superconductor CeRu 2 having T c = 6.1 K in the temperature range of 1.3-30 K. From the 9y Ru NMR in 10.2 T above H c2 , T{T-const was found in the measured-T range, and the value of T,TK 2 is almost the same as that in the uncorrelated Korringa relation, suggesting that there does not exist the strong spin fluctuation of Ru d-spins. The property of the superconducting state was investigated by using Ru NQR. We observed the Hebel-Slichter peak just below T c and the exponential decrease in 1 /T,, indicating that this superconductivity has an ordinary s-wave character. The effect of Al substitution for Ru was also studied by NMR and NQR. 
  Reference    Z. Naturforsch. 51a, 793—796 (1996); received February 1 1996 
  Published    1996 
  Keywords    Superconductor CeRu 2, NMR, NQR, T, Knight shift 
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 TEI-XML for    default:Reihe_A/51/ZNA-1996-51a-0793.pdf 
 Identifier    ZNA-1996-51a-0793 
 Volume    51 
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