Química Física y Analítica
Departamento
Technical University of Darmstadt
Darmstadt, AlemaniaPublicaciones en colaboración con investigadores/as de Technical University of Darmstadt (7)
2022
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Crystal structures of six 4-(4-nitrophenyl)piperazin-1-ium salts
Acta Crystallographica Section E: Crystallographic Communications, Vol. 78, pp. 510-518
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Crystal-structure studies of 4-phenylpiperazin-1-ium 4-ethoxybenzoate monohydrate, 4-phenylpiperazin-1-ium 4-methoxybenzoate monohydrate, 4-phenylpiperazin-1-ium 4-methylbenzoate monohydrate and 4-phenylpiperazin-1-ium trifluoroacetate 0.12-hydrate
Acta Crystallographica Section E: Crystallographic Communications, Vol. 78, pp. 709-715
2021
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Crystal structure studies of 4-ethylpiperazin-1-ium 3,5-dinitrobenzoate, 4-methylpiperazin-1-ium 3,5-dinitrobenzoate and 4-methylpiperazin-1-ium 4-iodobenzoate
Acta Crystallographica Section E: Crystallographic Communications, Vol. 77, pp. 1135-1139
2017
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Ferromagnetic orderings in CoxCuyZn1−(x+y)O by GGA and GGA+U formalisms within density functional theory
Computational Materials Science, Vol. 126, pp. 344-350
2015
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A Comparative DFT and DFT+U Study on Magnetism in Nickel-Doped Wurtzite AlN
Journal of Superconductivity and Novel Magnetism, Vol. 28, Núm. 11, pp. 3185-3192
2014
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A comparative DFT study of the structural and electronic properties of nonpolar GaN surfaces
Applied Surface Science, Vol. 314, pp. 794-799
2004
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Thermal expansion of spinel-type Si3N4
Physical Review B - Condensed Matter and Materials Physics, Vol. 69, Núm. 5