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To test the accuracy of this approxima- atoms ( the upper ring ) . tion , we performed B3LYP / 6-316 calculations of vibrational frequencies of the C60 , C70 , and C20H20 molecules and compared our results with the experimental ...
To test the accuracy of this approxima- atoms ( the upper ring ) . tion , we performed B3LYP / 6-316 calculations of vibrational frequencies of the C60 , C70 , and C20H20 molecules and compared our results with the experimental ...
Trang 762
Computer - aided processing of all the variants showed that none of them corresponds to the experimental spectrum . In all the cases , the error exceeds or is close to 10 % . As an illustration , the table summarizes the best variants ...
Computer - aided processing of all the variants showed that none of them corresponds to the experimental spectrum . In all the cases , the error exceeds or is close to 10 % . As an illustration , the table summarizes the best variants ...
Trang 785
The experimental values of equilibrium pH and vanadium concentrations obtained in the study of hexavanadate solubilities in alkali - free H2SO4 solutions are given in Table 1. The value of a , as derived from the equation a = VO ...
The experimental values of equilibrium pH and vanadium concentrations obtained in the study of hexavanadate solubilities in alkali - free H2SO4 solutions are given in Table 1. The value of a , as derived from the equation a = VO ...
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Nội dung
Vol 49 No 5 | 662 |
Synthesis and XRay Diffraction Characteristics of MMgDyMn206 M Li Na K | 674 |
Synthesis and Crystal Structure | 685 |
Bản quyền | |
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absorption according acid activation addition analysis angles anion appear atoms band bond cage calculated carbon cation cell changes charge Chem chemical Chemistry clusters compared complexes composition compounds concentration constants containing coordination Copyright corresponding crystal curves decreases determined distances effect electron energy enthalpy existence experimental extraction formation formed frequencies function groups heating HTSC hydrides hydrogen increase Inorg Inorganic interaction ionic ions Journal Khim layers lengths ligand magnetic materials measured melting metal method mixture mol/l molecules Moscow Neorg observed obtained oxide oxygen parameters phase Physics plane positions prepared presence properties range ratio reaction REFERENCES respectively Russian salt sample Sciences shifts shows similar solid solution space group spectra spectrum stability structure studied symmetry synthesis Table temperature thermal tion transition unit values vibrations
Thông tin thư mục
| Tiêu đề | Russian Journal of Inorganic Chemistry, Tập 49,Số phát hành 5-7 |
| Cộng tác viên | British Library. Lending Division, Royal Society of Chemistry (Great Britain), Chemical Society (Great Britain) |
| Nhà xuất bản | British Library Lending Division with the cooperation of the Royal Society of Chemistry, 2004 |
| Xuất lời trích dẫn | BiBTeX EndNote RefMan |