Russian Journal of Inorganic Chemistry, Tập 43,Số phát hành 9-12British Library Lending Division with the cooperation of the Royal Society of Chemistry, 1998 |
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... frequencies of hydride and fluoride anions were recalculated using the correlated MP2 / 6-31G * approximation , and total energies of hydrides were refined within the framework of the quadratic configu- ration interaction method with ...
... frequencies of hydride and fluoride anions were recalculated using the correlated MP2 / 6-31G * approximation , and total energies of hydrides were refined within the framework of the quadratic configu- ration interaction method with ...
Trang 1410
... frequencies of the AF anion may be substantial . Note that the abso- lute errors ( compared to the experimental data ) of Har- tree - Fock calculations of vibrational frequencies essentially decrease in going from fluorides to chlo ...
... frequencies of the AF anion may be substantial . Note that the abso- lute errors ( compared to the experimental data ) of Har- tree - Fock calculations of vibrational frequencies essentially decrease in going from fluorides to chlo ...
Trang 1582
... frequencies v ;. Table 4. ( Contd . ) ( c ) L2AO3 molecules and ions , structure 3 ( bb ) , C2v Molecule Z ( L ) Z ( Ob ) Z ( A ) Z ( 0 , ) Q ( AOb ) Q ( AO , ) Q ( LOb ) Q ( LO , ) Li2BO3 0.35 -1.03 1.11 0.14 0.36 0.20 0.26 Na2BO3 0.45 ...
... frequencies v ;. Table 4. ( Contd . ) ( c ) L2AO3 molecules and ions , structure 3 ( bb ) , C2v Molecule Z ( L ) Z ( Ob ) Z ( A ) Z ( 0 , ) Q ( AOb ) Q ( AO , ) Q ( LOb ) Q ( LO , ) Li2BO3 0.35 -1.03 1.11 0.14 0.36 0.20 0.26 Na2BO3 0.45 ...
Nội dung
Synthesis and Properties of Inorganic Compounds | 1301 |
Xray Diffraction Study of LnMn2O5 5 Ln La Nd M Ca Ba LIBRARY | 1308 |
Synthesis of MolybdenumIV Oxide in Lithium ChloridePotassium Chloride EutecticMelts | 1317 |
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absorption according acid addition analysis angle anions aqueous atoms band bond bridging calculated cation changes charge Chem chemical Chemistry chloride cm-¹ complexes composition compounds concentration constant containing coordination Copyright corresponding crystal curves decomposition decrease derivatives described determined diagram distances effect electron energy enthalpies experimental extraction formation frequencies H₂O heating higher hydrogen increase indicates initial Inorganic intensity interaction ions Khim kJ/mol ligand measured melt metal method mixed mixture mol/l molecules Moscow Neorg observed obtained occur oxide oxygen parameters phase phosphate positions powder prepared presented properties Publishing range ratio reaction REFERENCES region respectively Russian salts samples shift shows similar sodium solid solution space group spectra spectrum stability structure studied synthesis Table temperature thermal tion Translation unit values vibrations X-ray diffraction