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Published in 2020 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-020-4345-4
Abstract: The detailed illustrations of the structures, elastic properties, and Raman and IR vibration modes for [Na(H2O)(N5)]·2H2O (a) and [Mg(H2O)6(N5)2]·4H2O (b) have been presented in this investigation by using the first-principles method based on the density…
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Keywords:
raman vibration;
vibration;
2h2o h2o;
h2o 2h2o ... See more keywords
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Published in 2018 at "Journal of Molecular Liquids"
DOI: 10.1016/j.molliq.2018.04.016
Abstract: Abstract H2EMT has been separated into divalent cadmium, mercury, and platinum complexes. The structures of the complexes were identified by various physico-chemical and spectroscopic techniques (UV–vis., IR, Mass Spectrometry and NMR). The FTIR results show…
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Keywords:
crystal structure;
h2o 2h2o;
hemt h2o;
h2emt ... See more keywords
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Published in 2019 at "Journal of Molecular Structure"
DOI: 10.1016/j.molstruc.2019.05.119
Abstract: Abstract An acetate bridged coordination polymer of lanthanum, formulated as {[La(μ-CH3COO)(PDC)(H2O)2].2H2O}n (H2PDC = pyridine-3,4-dicarboxylic acid) has been successfully grown by single gel diffusion technique at room temperature using hydrosilica gel and further characterized by elemental analysis, powder…
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Keywords:
h2o 2h2o;
bridged coordination;
acetate bridged;
ch3coo pdc ... See more keywords
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Published in 2019 at "Polyhedron"
DOI: 10.1016/j.poly.2019.04.056
Abstract: Abstract A series of lanthanide(III) oxamate complexes of formula Na[Eu(4-HOpa)4(H2O)]∙2H2O (1), Na[Gd(4-HOpa)4(H2O)]∙2H2O (2), Na[Dy(4-HOpa)4(H2O)]∙2H2O (3), and Na[Ho(4-HOpa)4(H2O)]∙2H2O (4) (4-HOpa = N-4-hydroxyphenyloxamate) were synthesized and characterized. The crystal structures of complexes 1–4, as well as the oxamate ligand…
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Keywords:
2h2o hopa;
iii;
hopa h2o;
h2o 2h2o ... See more keywords
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Published in 2017 at "Mineralogical Magazine"
DOI: 10.1180/minmag.2016.080.098
Abstract: Abstract Wilhelmgümbelite, ideally [ZnFe2+Fe3+3(PO4)3(OH)4(H2O)5]·2H2O, is a new secondary phosphate mineral related closely to schoonerite, [ZnMnFe2+2 Fe3+(PO4)3(OH)2(H2O)7]·2H2O, from oxidized zones of the Hagendorf-Süd pegmatite, Hagendorf, Oberpfalz, Bavaria, Germany. Wilhelmgümbelite occurs as radiating sprays of needle-like rectangular…
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Keywords:
wilhelmg mbelite;
mineral;
h2o 2h2o;
po4 h2o ... See more keywords