Russian Journal of Inorganic Chemistry, Tập 49,Số phát hành 5-7British Library Lending Division with the cooperation of the Royal Society of Chemistry, 2004 |
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Trang 725
... frequencies ; therefore , we restricted our- selves to B3LYP / 6-31G calculations ignoring polariza- tion functions . To test the accuracy of this approxima- tion , we performed B3LYP / 6-31G calculations of vibrational frequencies of ...
... frequencies ; therefore , we restricted our- selves to B3LYP / 6-31G calculations ignoring polariza- tion functions . To test the accuracy of this approxima- tion , we performed B3LYP / 6-31G calculations of vibrational frequencies of ...
Trang 730
... frequencies of the He , clus- ter in He4 @ C60H36 are close to the analogous vibra- tional frequencies of the endohedral CH4 molecule ; in addition , these vibrations are coupled not only to the deformation vibrations of the cage but ...
... frequencies of the He , clus- ter in He4 @ C60H36 are close to the analogous vibra- tional frequencies of the endohedral CH4 molecule ; in addition , these vibrations are coupled not only to the deformation vibrations of the cage but ...
Trang 878
... frequencies Vrot of the guest ( ~ 340 and ~ 225 cm - 1 ) for the endohedral NH @ C84 cation and BH @ C84 anion are comparable with experimen- tal frequencies of ammonium librations in solid salts of the NH X - type with X = Hal , AIF4 ...
... frequencies Vrot of the guest ( ~ 340 and ~ 225 cm - 1 ) for the endohedral NH @ C84 cation and BH @ C84 anion are comparable with experimen- tal frequencies of ammonium librations in solid salts of the NH X - type with X = Hal , AIF4 ...
Nội dung
Vol 49 No 5 | 661 |
Synthesis and Properties of Inorganic Compounds | 669 |
Synthesis and XRay Diffraction Characteristics of MMgDyMn2O6 M Li Na K | 674 |
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ų absorption Academy of Sciences acid analysis angles anion aqueous atoms band binary bond lengths cage calculated CaO2 carbon cation chains Chem chemical clusters cm-¹ complexes composition compounds concentration constants coordination crystal structure curves decreases electron energy English Translation Copyright enthalpy equilibrium ethanol experimental extraction formation formed frequencies g/cm³ gold(III H₂O heating HTSC hydrides hydrogen bonds increase Inorg interaction ions iridium(IV Khim kJ/mol lanthanide layers ligand magnetic MAIK Nauka/Interperiodica melting metal mixture mol/l monoclinic Moscow Nauka Neorg nH₂O Original Russian Text orthorhombic oxide oxygen oxygen atoms perovskite phase Phys plexes polyanions properties protons range ratio reaction reagent Russ Russia Received Russian Academy Russian Journal Russian Text Copyright salt sample solid solution spectra spectrum stability studied superconducting symmetry synthesis Table temperature thermal tion trans unit cell values vibrations water molecules X-ray diffraction