Russian Journal of Inorganic Chemistry, Tập 42,Số phát hành 5-8British Library Lending Division with the cooperation of the Royal Society of Chemistry, 1997 |
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... calculated values . As can be seen from Fig . 3 , dimerization slightly changes the geometry of formic acid , in agreement with previously reported data [ 19 ] . According to ab initio calculations , symmet- rical cyclic structure 7 ...
... calculated values . As can be seen from Fig . 3 , dimerization slightly changes the geometry of formic acid , in agreement with previously reported data [ 19 ] . According to ab initio calculations , symmet- rical cyclic structure 7 ...
Trang 1063
... calculated with the use of ECP and com- pare them with the parameters calculated with the inclusion of all electrons . The ROHF calculations with the use of ECP result in the same parameters as the all- electron ROHF calculations : the ...
... calculated with the use of ECP and com- pare them with the parameters calculated with the inclusion of all electrons . The ROHF calculations with the use of ECP result in the same parameters as the all- electron ROHF calculations : the ...
Trang 1207
... calculated by Clementi et al . as early as 1970 [ 12 ] . To date , several dozen papers are known in this field . In [ 13-15 ] , the calculated PESS were used to solve dynamic problems for LiCN , LiO2 , LIBO2 , and other molecules . In ...
... calculated by Clementi et al . as early as 1970 [ 12 ] . To date , several dozen papers are known in this field . In [ 13-15 ] , the calculated PESS were used to solve dynamic problems for LiCN , LiO2 , LIBO2 , and other molecules . In ...
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Vol 42 No 5 | 613 |
Intercalation Compounds of VanadiumV Phosphates with Glycerol | 620 |
Interaction of Tin Dichloride with Liquid Chlorine in Alloys of SnCl2 with Alkali Metal Chlorides | 631 |
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absorption Academy of Sciences acid Akad analysis angles anion annealed aqueous solutions atoms bond lengths calculated cation chelate Chem chemical chloride cm-¹ complexes composition compounds concentration constants coordination copper(II corresponding crystal structure curves decomposition decrease determined dimer electron energy English Translation Copyright enthalpy equation equilibrium ethylenediamine experimental extraction formation fullerene H₂O Hayka/Interperiodica Publishing Russia heat hydrate hydrogen bonds hydroxide increase Inorganic Chemistry interaction ions Khim kJ/mol Li₂O ligand liquid melting metal method mol/l Moscow Nauk SSSR Neorg obtained Original Russian Text oxidation oxygen atoms phase diagram Phys plexes polyhedra properties proton ratio reaction rhodium Russia Received Russian Academy Russian Journal Russian Text Copyright salts samples solid solutions solubility solvation solvent space group spectra spectrum stability studied synthesis Table temperature thermal thermoanalytical thermodynamic tion titanium values vibrations water molecules X-ray diffraction zirconium Ꮓ Ꮓ Ꮓ