Russian Journal of Inorganic Chemistry, Tập 43,Trang 1-464Chemical Society., 1998 |
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Kết quả 1-3 trong 86
Trang 241
... Calculated and experimental characteristics of linear molecules and. L Bb B 5 , C1 B Bb Вь B A PA B B B B B 1 , C2v 2 ... calculated both by the Hartree - Fock ( HF ) method and by the sec- ond order Møller - Plesset perturbation theory ...
... Calculated and experimental characteristics of linear molecules and. L Bb B 5 , C1 B Bb Вь B A PA B B B B B 1 , C2v 2 ... calculated both by the Hartree - Fock ( HF ) method and by the sec- ond order Møller - Plesset perturbation theory ...
Trang 405
... calculations of the CH , CN molecule and the [ Pt ( CH3CN ) Cl3 ] complex . Based on results of ab initio calculations of force fields , we calculated frequencies of normal vibrations of these compounds using the GAMESS program package ...
... calculations of the CH , CN molecule and the [ Pt ( CH3CN ) Cl3 ] complex . Based on results of ab initio calculations of force fields , we calculated frequencies of normal vibrations of these compounds using the GAMESS program package ...
Trang 411
... calculated energies of decomposition by the scheme LAX , → LX + AX2 and AX3 → X- + AX2 were found to be overestimated by 10-15 kcal / mol rel- ative to mass - spectrometry data ( the survey of early results was presented in [ 15 ] ...
... calculated energies of decomposition by the scheme LAX , → LX + AX2 and AX3 → X- + AX2 were found to be overestimated by 10-15 kcal / mol rel- ative to mass - spectrometry data ( the survey of early results was presented in [ 15 ] ...
Nội dung
Synthesis and Properties of Inorganic Compounds | 1 |
Preparation and Properties | 9 |
Thermal Behavior of Aluminum Hydroxide Prepared by Ion Exchange | 18 |
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absorption acetonitrile acid analysis angle anion aqueous atoms band bond lengths calcd calculated cation Chem chemical chloride chlorination cm-¹ composition compounds concentration coordination corresponding crystal decomposition decrease dioxane DMSO electron electron correlation energy English Translation Copyright enthalpies equilibrium experimental Fe(III films fluorides formation frequencies H₂O Hayka/Interperiodica Publishing Russia HF MP2 HF hydride hydrogen hydrogen bonds hydrolysis hydroxide hydroxo complexes hydroxylapatite increase Inorganic Chemistry interaction ions isomers kcal/mol Khim kinetic kJ/mol ligand lithium magnetic metal methanol method mol/l molecules Moscow MP2 HF MP2 Neorg nitrogen Original Russian Text oxide oxygen phase plexes pressure ratio reaction rhenium Russia Received Russian Academy Russian Journal Russian Text Copyright salts sample silicon SnCl2 sodium solid solutions solvent spectra spectrum structure studied surface synthesis Table temperature thermal tion titanium unit cell unit cell parameters values vibration X-ray diffraction X-ray powder diffraction