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31.
R. P. Bickerstaff B. H. J. McKellar 《Zeitschrift fur Physik C Particles and Fields》1982,16(2):171-179
With the inclusion of a single gluon magnetic exchange term, the M.I.T. static spherical cavity spectrum of \(q^2 \bar q^2 \) bag eigenstates contains a pair of nearly degenerateJ P=0+ states in both theI=0 and 1 channels; possibly associated with theS *(980) and δ(980). The effect of pair annihilation-induced mixing on these states is investigated and is shown to result in radical changes. For small mixing the bag energy curves have two minima. As the mixing strength is increased, one of these minima disappears and is replaced by a new higher lying state. 相似文献
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33.
The structures and rotational dynamics of clusters of a single carbon monoxide molecule solvated in para-hydrogen, (paraH(2))(N)-CO, have been simulated for sizes up to N=17 using the reptation Monte Carlo technique. The calculations indicate the presence of two series of R(0) rotational transitions with J=1<--0 for cold clusters, similar to those predicted and observed in the case of He(N)-CO. Infrared spectra of these clusters have been observed in the region of the C-O stretch ( approximately 2143 cm(-1)) in a pulsed supersonic jet expansion using a tunable diode laser probe. With the help of the calculations, the observed R(0) rotational transitions have been assigned up to N=9 for the b-type series and N=14 for the a-type series. Theory and experiment agree rather well, except that theory tends to overestimate the b-type energies. The (paraH(2))(12)-CO cluster is calculated to be particularly stable and (relatively) rigid, corresponding to completion of the first solvation shell, and it is observed to have the strongest a-type transition. 相似文献
34.
N. S. Allen J. F. McKellar G. O. Phillips 《Journal of polymer science. Part A, Polymer chemistry》1974,12(6):1233-1241
The phosphorescence from the nylon polymers 6, 66, 11, and 12 has been studied from the aspects of excitation and emission wavelength location and of emission lifetime. In contrast to the other nylons, the 66 polymer exhibits two distinct phosphorescence bands, both of which are sensitive to thermal and photochemical oxidation of the polymer. The species responsible for these emissions are concluded to be carbonyl in nature and their role in the complex reactions that occur during thermal and photochemical oxidation of the polymer is discussed. 相似文献
35.
McKellar AR 《The Journal of chemical physics》2004,121(14):6868-6873
Infrared spectra of isotopically substituted HeN-CO clusters (1 < N < 19) have been studied in order to extend the original results on the normal isotope. The same two series of R(0) transitions were observed, correlating with the a- and b-type transitions of He1-CO, with only small shifts in relative position. The previously obscured a-type line for He6-CO was detected. Examination of the small shifts among isotopomers showed remarkably smooth behavior, except in the "unstable" regions around N=7 (b-type series) and 15 (a-type series). The overall results firmly support the assignments and analysis given for the normal isotope. 相似文献
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37.
Infrared spectra of He(N)-CO(2) clusters with N up to about 20 have been studied in the region of the CO(2) nu(3) fundamental band ( approximately 2350 cm(-1)) using a tunable diode laser spectrometer and pulsed supersonic jet source with cooled (>-150 degrees C) pinhole or slit nozzles and high backing pressures (<40 atm). Compared to previous studies of He(N)-OCS and -N(2)O clusters, the higher symmetry of CO(2) results in simpler spectra but less information content. Discrete rotation-vibration transitions have been assigned for N=3-17, and their analysis yields the variation of the vibrational band origin and B rotational constant over this size range. The band origin variation is similar to He(N)-OCS, with an initial blueshift up to N=5, followed by a monotonic redshift, consistent with a model where the first five He atoms fill a ring around the equator of the molecule, forcing subsequent He atom density to locate closer to the ends. The B value initially drops as expected for a normal molecule, reaching a minimum for N=5. Its subsequent rise for N=6 to 11 can be interpreted as the transition from a normal (though floppy) molecule to a quantum solvation regime, where the CO(2) molecule starts to rotate separately from the He atoms. For N>13, the B value becomes approximately constant with a value about 17% larger than that measured in much larger helium nanodroplets. 相似文献
38.
High-resolution infrared spectra of clusters containing para-H2 and/or ortho-H2 and a single nitrous oxide molecule are studied in the 2225-cm(-1) region of the upsilon1 fundamental band of N2O. The clusters are formed in pulsed supersonic jet expansions from a cooled nozzle and probed using a tunable infrared diode laser spectrometer. The simple symmetric rotor-type spectra generally show no resolved K structure, with prominent Q-branch features for ortho-H2 but not para-H2 clusters. The observed vibrational shifts and rotational constants are reported. There is no obvious indication of superfluid effects for para-H2 clusters up to N=13. Sharp transitions due to even larger clusters are observed, but no definite assignments are possible. Mixed (para-H2)N-(ortho-H2)M-N2O cluster line positions can be well predicted by linear interpolation between the corresponding transitions of the pure clusters. 相似文献
39.
A.R.W. McKellar 《Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy》2006,63(5):959
A 2.3 μm near-room temperature tunable diode laser was tested for applications in high-resolution laboratory spectroscopy. It was mounted using a simple adaptor in a spectrometer usually used with lead-salt diode lasers, and was found to be electrically and optically compatible with the system. Good output power (several milliwatts) was observed, and a tuning range of 4460–4150 cm−1 was achieved for laser temperatures of 210–310 K. Some spectra of N2O and NH3 were recorded in the 4300–4430 cm−1 region. However, the laser was not generally useful due to noisy and unstable output and high sensitivity to optical feedback. 相似文献
40.
Gemma F. Turner Scott C. McKellar David R. Allan Anthony K. Cheetham Sebastian Henke Stephen A. Moggach 《Chemical science》2021,12(41):13793
The guest-dependent flexibility of the pillared-layered metal–organic framework (MOF), Zn2bdc2dabco·X(guest), where guest = EtOH, DMF or benzene, has been examined by high-pressure single crystal X-ray diffraction. A pressure-induced structural phase transition is found for the EtOH- and DMF-included frameworks during compression in a hydrostatic medium of the guest species, which is dependent upon the nature and quantity of the guest in the channels. The EtOH-included material undergoes a phase transition from P4/mmm to C2/m at 0.69 GPa, which is accompanied by a change in the pore shape from square to rhombus via super-filling of the pores. The DMF-included material undergoes a guest-mediated phase transition from I4/mcm to P4/mmm at 0.33 GPa via disordering of the DMF guest. In contrast, the benzene-included framework features a structure with rhombus-shaped channels at ambient pressure and shows direct compression under hydrostatic pressure. These results demonstrate the large influence of guest molecules on the high-pressure phase behavior of flexible MOFs. Guest-mediated framework flexibility is useful for engineering MOFs with bespoke pore shapes and compressibility.The guest-dependent flexibility of the pillared-layered metal–organic framework (MOF), Zn2bdc2dabco·X(guest), where guest = EtOH, DMF or benzene, has been examined by high-pressure single crystal X-ray diffraction. 相似文献