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1.
Ulrich Burkert 《Tetrahedron》1979,35(5):691-695
The geometries and energies of polymethyl-1,3-dioxanes were studied by molecular mechanics calculations. Buttressing effects of the Me groups are discussed. The chair/twist conformational equilibrium of 1,3-dioxanes having two syn-axial Me groups in the chair were calculated, and a twist form (the 1,4-twist) is found to be more stable than the chair only for 9 and 14, chair and 2,5-twist form are of comparable energies for 10 and 13, and the chair is considerably favored in 11 and 12. The chair/1,4-twist energy difference of 1 was calculated to be only 16.4 kJ mol?1. Ring inversion of 1 goes through a transition state with C-C-C-O coplanar with a calculated activation enthalpy of 28.3 kJ mol?1. 相似文献
2.
U. Burkert 《Tetrahedron》1977,33(17):2237-2242
The treatment of oxygen lone pairs in force field calculations is discussed. The geometries of 1,3-dioxanes can be calculated well without explicit account of lone pairs. For the calculation of conformational energies in 5-alkyl-1,3-dioxanes electrostatic interactions between point charges taken from quantum mechanical calculations must be included. Addition of van der Waals interactions of lone pairs as weak potentials further improves the calculated conformational energies. 相似文献
3.
Volker D. Burkert 《Czechoslovak Journal of Physics》1996,46(7-8):627-671
In these lectures the status of electromagnetic excitation of nucleon resonances is reviewed and some of the open problems of the structure and spectroscopy of light-quark baryons are discussed. The basic formalism for describing electromagnetic processes is introduced but not derived.Lecture given at the 8th Summer School on Intermediate-Energy Physics: Hadron Dynamics at Low and Intermediate Energies, Prague, July 10–14, 1995. 相似文献
4.
5.
Prof. Dr. E. Nachbaur A. Popitsch P. Burkert 《Monatshefte für Chemie / Chemical Monthly》1974,105(4):822-833
According to spectroscopic (IR, broadline proton NMR) and chemical (alkylation) investigations of disilver sulphamide the following molecular structure is assumed: $$\begin{gathered} O \hfill \\ || \hfill \\ H_2 N\_\_S\_\_NAg| \hfill \\ OAg \hfill \\ \end{gathered}$$ From the IR and NMR data deduction concerning the nature of the chemical bonds in this compound is possible. The instability of the still unknown mono-and trisilver sulphamide is discussed with regard to the structure of disilver sulphamide. 相似文献
6.
Molecular mechanics calculations indicate that the deformed chair and twisted-boat conformations are similar in energy for a 4,4-dimethyl-3-keto steroid. Earlier dipole moment work on such compounds is discussed. The crystal structure of 4,4-dimethylandrostan-3-on-17β-yl benzoate has been determined. The crystals are orthorhombic, P212121, a = 17.096 (2), b = 22.136 (e), c = 6.217 (1) A. The structure was solved by direct methods and refined by least squares to R ? 0.039, RXXX = 0.038, based on 2168 observed reflections. Ring A is shown to exist in a chair form, deformed as indicated by the calculations. 相似文献
7.
Volker D. Burkert 《中国物理 C》2009,33(12):1043-1050
Recent measurements of nucleon resonance transition form factors with CLAS at Jefferson Lab are discussed. The new data confirm the assertion of the symmetric constituent quark model of the Roper as the first radial excitation of the nucleon. The data on high Q2 nπ+ production better constrain the branching ratios liNK and [3Nn. For the first time, the longitudinal transition amplitude to the S11(1535) was extracted from the nπ+ data. Also, new results on the transition amplitudes for the D13(1520) resonance are presented showing a rapid transition from helicity 3/2 dominance seen at the real photon point to helicty 1/2 dominance at higher Q2. I also discuss the status of the search for new excited nucleon states. 相似文献
8.
De Vita R Anghinolfi M Burkert VD Dodge GE Minehart R Taiuti M Weller H Adams G Amaryan MJ Anciant E Armstrong DS Asavapibhop B Asryan G Audit G Auger T Avakian H Bagdasaryan H Ball JP Barrow S Battaglieri M Beard K Bektasoglu M Bianchi N Biselli AS Boiarinov S Bonner BE Bosted P Bouchigny S Branford D Brooks WK Bueltmann S Calarco JR Capitani GP Carman DS Carnahan B Cazes A Ciciani L Cole PL Coleman A Connelly J Cords D Corvisiero P Crabb D Crannell H Cummings JP De Sanctis E Degtyarenko PV 《Physical review letters》2002,88(8):082001
The double spin asymmetry in the (-->)e(-->)p --> e(prime)pi(+)n reaction has been measured for the first time in the resonance region for four-momentum transfer Q2 = 0.35-1.5 GeV(2). Data were taken at Jefferson Lab with the CLAS detector using a 2.6 GeV polarized electron beam incident on a polarized solid NH3 target. Comparison with predictions of phenomenological models shows strong sensitivity to resonance contributions. Helicity-1/2 transitions are found to be dominant in the second and third resonance regions. The measured asymmetry is consistent with a faster rise with Q(2) of the helicity asymmetry A1 for the F(15)(1680) resonance than expected from the analysis of the unpolarized data. 相似文献
9.
Joo K Smith LC Burkert VD Minehart R Aznauryan IG Elouadrhiri L Stepanyan S Adams GS Amaryan MJ Anciant E Anghinolfi M Armstrong DS Asavapibhop B Audit G Auger T Avakian H Barrow S Bagdasaryan H Battaglieri M Beard K Bektasoglu M Bertozzi W Bianchi N Biselli AS Boiarinov S Bonner BE Brooks WK Calarco JR Capitani GP Carman DS Carnahan B Cole PL Coleman A Cords D Corvisiero P Crabb D Crannell H Cummings J De Sanctis E De Vita R Degtyarenko PV Demirchyan RA Denizli H Dennis LC Deppman A 《Physical review letters》2002,88(12):122001
Models of baryon structure predict a small quadrupole deformation of the nucleon due to residual tensor forces between quarks or distortions from the pion cloud. Sensitivity to quark versus pion degrees of freedom occurs through the Q2 dependence of the magnetic (M1+), electric (E1+), and scalar (S1+) multipoles in the gamma*p-->Delta(+)-->p pi(0) transition. We report new experimental values for the ratios E(1+)/M(1+) and S(1+)/M(1+) over the range Q2 = 0.4-1.8 GeV2, extracted from precision p(e,e(')p)pi(0) data using a truncated multipole expansion. Results are best described by recent unitary models in which the pion cloud plays a dominant role. 相似文献