Russian Journal of Inorganic Chemistry, Tập 44,Trang 461-995Chemical Society., 1999 |
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Kết quả 1-3 trong 86
Trang 577
... calculations of its electronic structure with full geometry optimization and calculated normal vibration frequencies with the GAMESS program package [ 2 ] . The Dunning - Hay valence double - basis set was used [ 3 ] . The results of ...
... calculations of its electronic structure with full geometry optimization and calculated normal vibration frequencies with the GAMESS program package [ 2 ] . The Dunning - Hay valence double - basis set was used [ 3 ] . The results of ...
Trang 579
... calculated values are 3339 ( B , ) and 3274 cm - 1 ( A1 ) . According to the gas - phase experimental data [ 8 ] , these vibrational frequencies appear near 3000 cm - 1 . In the calculated spectrum of dicyanomethane , C = N stretch- ing ...
... calculated values are 3339 ( B , ) and 3274 cm - 1 ( A1 ) . According to the gas - phase experimental data [ 8 ] , these vibrational frequencies appear near 3000 cm - 1 . In the calculated spectrum of dicyanomethane , C = N stretch- ing ...
Trang 738
... Calculated interatomic distances R ( A - B ) (. Original Russian Text Copyright © 1999 by Panina , Kukushkin . English Translation Copyright © 1999 by MAHK “ Hayka / Interperiodica " ( Russia ) . = Ab initio calculations [ 1 ] reproduce ...
... Calculated interatomic distances R ( A - B ) (. Original Russian Text Copyright © 1999 by Panina , Kukushkin . English Translation Copyright © 1999 by MAHK “ Hayka / Interperiodica " ( Russia ) . = Ab initio calculations [ 1 ] reproduce ...
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Contents | 463 |
Synthesis and Properties of Inorganic Compounds | 469 |
The Crystal Structure of Indium Perchlorates InH2O6ClO43 and InH2O6ClO43 3H2O | 476 |
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absorption acid analysis anions annealed atoms band bond lengths calculated carbonate cations Chem chemical chloride cm-¹ coefficient complex components composition compounds concentration coordination copper corresponding crystal curve decomposition decrease determined diffraction patterns dimers electron energy English Translation Copyright equilibrium experimental extraction formation H₂O heating hydrogen hydrolysis hydroxide increase interaction isotherms kcal/mol Khim lanthanide layer ligand lithium MAHK Hayka/Interperiodica melting metal methanol method mixture mol/l molecules Moscow NaHCO3 Nauka Neorg nitrate obtained Original Russian Text oxidation oxygen oxygen atoms phase diagram PHYSICOCHEMICAL potassium proton range ratio reaction region Russia Received Russian Academy Russian Journal Russian Text Copyright salt samples sodium solid solutions solu solubility sorbents space group spectra spectrum stability structure studied sulfur synthesis Table temperature ternary thermal tion unit cell unit cell parameters unithiol values vanadium vibrations X-ray diffraction X-ray powder diffraction