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... complexes , calculated by using the RHF / 3-21G and MNDO approximations MNDO RHF / 3-21G Structural parameters Electron ... Q is a Mulliken overlap population in ab initio calculations and a Wiberg index in MNDO calculations .
... complexes , calculated by using the RHF / 3-21G and MNDO approximations MNDO RHF / 3-21G Structural parameters Electron ... Q is a Mulliken overlap population in ab initio calculations and a Wiberg index in MNDO calculations .
Trang 1691
The E , values , required for the solution of equation ( 3 ) , were calculated by the Henderson equation [ 8 ] , using the mobilities of the ions in infinitely dilute solutions [ 9 ] . Using the Davies equation [ 10 ] , the Y2 + values ...
The E , values , required for the solution of equation ( 3 ) , were calculated by the Henderson equation [ 8 ] , using the mobilities of the ions in infinitely dilute solutions [ 9 ] . Using the Davies equation [ 10 ] , the Y2 + values ...
Trang 1946
Calculated and observed mean vibrational amplitudes lij , ... To verify the accuracy of the numerical method of determining force constants , calculations in the HF / II approximation were also per- formed by the analytical method .
Calculated and observed mean vibrational amplitudes lij , ... To verify the accuracy of the numerical method of determining force constants , calculations in the HF / II approximation were also per- formed by the analytical method .
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Barium Alkoxozirconates | 1527 |
Synthesis and Properties of Zirconium Niobium and Tantalum Oxide Films | 1534 |
Polymorphism in Cobalt Metavanadate | 1540 |
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absorption According acid analysis angles anion aqueous atoms bands basis bismuth bond calculated cation Chem chemical Chemistry chloride cm-¹ complexes composition compounds concentration constants containing coordination Copyright corresponding crystals curves decrease dependence determined distances effect electron energy equation equilibrium experimental extraction formation frequencies functions groups heat hydrogen increase indicates Inorganic interaction ionic ions Khim kJ/mol ligand melt metal method mixture molecule Moscow Neorg Note observed obtained occurs organic Original oxides oxygen parameters performed peritectic phase position possible precipitate prepared presented properties Publishing range ratio reaction REFERENCES region respectively Russian salts samples Sciences shows similar sodium solid solubility solutions space group spectra spectrum stability structure studied synthesis Table temperature thermal tion transition Translation unit values vibrations X-ray diffraction
Thông tin thư mục
| Tiêu đề | Russian Journal of Inorganic Chemistry, Tập 40,Trang 1527-2028 |
| Cộng tác viên | British Library. Lending Division, Akademii︠a︡ nauk SSSR., Chemical Society (Great Britain), Royal Society of Chemistry (Great Britain) |
| Nhà xuất bản | British Library Lending Division with the cooperation of the Royal Society of Chemistry, 1995 |
| Nguyên bản từ | Đại học Michigan |
| Đă được số hóa | 9 Tháng 4 2010 |
| Xuất lời trích dẫn | BiBTeX EndNote RefMan |