Russian Journal of Inorganic Chemistry, Tập 39,Trang 1517-2026Chemical Society, 1994 |
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Table 1. Total energies ( a.u. ) for the molecular configurations calculated within the SCF / 3-21GF scheme and the energies of zero - point vibrations ( EZV , kcal / mol ) calculated using the frequencies obtained within the same ...
Table 1. Total energies ( a.u. ) for the molecular configurations calculated within the SCF / 3-21GF scheme and the energies of zero - point vibrations ( EZV , kcal / mol ) calculated using the frequencies obtained within the same ...
Trang 1783
... calculated by using equation ( 9 ) . Using the data for various concentra- tions CPd ( in ) and Cex ( in ) ( Table 2 ) , we obtained log K dim -4.23 0.09 ( P = 0.95 ; n = 8 ) . Using the values of K and Kdim , we can calculate the ...
... calculated by using equation ( 9 ) . Using the data for various concentra- tions CPd ( in ) and Cex ( in ) ( Table 2 ) , we obtained log K dim -4.23 0.09 ( P = 0.95 ; n = 8 ) . Using the values of K and Kdim , we can calculate the ...
Trang 1964
... calculated values for the heat capacity in the whole tem- perature range was achieved at the value of the hindering potential for the NO2 group equal to Vo = 16.7 kJ / mol . The calculated values of the other parameters in ( 1 ) are ...
... calculated values for the heat capacity in the whole tem- perature range was achieved at the value of the hindering potential for the NO2 group equal to Vo = 16.7 kJ / mol . The calculated values of the other parameters in ( 1 ) are ...
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Vol 39 No 10 1994 | 1517 |
Thermal Transformations of AmmoniumLithium Tripolyphosphates 1261 | 1525 |
Synthesis Composition V 39 | 1531 |
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absorption acid ammonium anions aqueous arsenic atoms bands binary bond calculated cations Chem chemical chloride cm-¹ cobalt(II coefficients complexes components composition concentration constants COORDINATION COMPOUNDS copper(II corresponding CsCl curve decomposition decrease determined dioctylamine electron elements English Translation Copyright equation equilibrium eutectic exhibit experimental extraction formation formula groups H₂O Hayka/Interperiodica Publishing Russia heating hydrate hydrazine hydrogen increase indium Inorg Inorganic Chemistry interaction ionic ions iron(III Khim ligand MAHK Hayka/Interperiodica Publishing melting metal methanol method mixture mol/l Moscow NaCl Neorg nickel(II obtained Original Russian Text oxide oxygen palladium parameters pentatop phase diagram plexes praseodymium precipitate properties ratio reaction Russia Received Russian Academy Russian Text Copyright salts samples sodium solid solution solubility spectra spectrum stability studied Synthesis Table temperature ternary thermal thermodynamic thermolysis tion trans values vanadium(V vapor vibrations water molecules X-ray diffraction X-ray powder diffraction zirconium