Publications of F. R. Wagner

Journal Article (89)

2006
Journal Article
Deeken, S.; Motz, G.; Bezugly, V.; Borrmann, H.; Wagner, F. R.; Kempe, R.: Metal-Metal Bonding in Sterically Frustrated Dipalladium Species. Inorganic Chemistry 45 (23), pp. 9160 - 9162 (2006)
Journal Article
Grin, Y.; Wagner, F. R.; Armbrüster, M.; Kohout, M.; Leithe-Jasper, A.; Schwarz, U.; Wedig, U.; Schnering, H. G. v.: CuAl2 revisited: Composition, crystal structure, chemical bonding, compressibility and Raman spectroscopy. Journal of Solid State Chemistry 179 (6), pp. 1707 - 1719 (2006)
Journal Article
Kirchner, M.; Gäbler, F.; Schnelle, W.; Wagner, F. R.; Niewa, R.: (La3Zx)Al and (Ce3Zx)Al with Z = C, N, O: preparation, physical properties and chemical bonding of metal-rich perovskites. Zeitschrift für Kristallographie 221 (5-7), pp. 543 - 553 (2006)
Journal Article
Kohout, M.; Wagner, F. R.; Grin, Y.: Atomic Shells From the Electron Localizability in Momentum Space. International Journal of Quantum Chemistry 106 (7), pp. 1499 - 1507 (2006)
Journal Article
Ormeci, A.; Rosner, H.; Wagner, F. R.; Kohout, M.; Grin, Y.: Electron Localization Function in Full-Potential Representation for Crystalline Materials. The Journal of Physical Chemistry A 110 (3), pp. 1100 - 1105 (2006)
Journal Article
Quitmann, C. C.; Bezugly, V.; Wagner, F. R.; Müller-Buschbaum, K.: Condensation of Rare Earth Pyrazolates: The Dimeric, Trimeric and Polymeric Units [Gd2(Pz)6(PzH)4], [Nd3(Pz)9(PzH)2] and 1[Eu(Pz)2(PzH)2]. Zeitschrift für Anorganische und Allgemeine Chemie 632 (7), pp. 1173 - 1186 (2006)
2005
Journal Article
Dashjav, E.; Kreiner, G.; Wagner, F. R.; Kniep, R.: On the crystal structure of Ce2[Mo2C3]. Zeitschrift für Kristallographie - Supplement 22, p. 144 - 144 (2005)
Journal Article
Kirchner, M.; Schnelle, W.; Wagner, F. R.; Kniep, R.; Niewa, R.: (A19N7)[In4]2 (A = Ca, Sr) and (Ca4N)[In2]: Synthesis, Crystal Structures, Physical Properties, and Chemical Bonding. Zeitschrift für Anorganische und Allgemeine Chemie 631 (8), pp. 1477 - 1486 (2005)
Journal Article
Kohout, M.; Pernal, K.; Wagner, F. R.; Grin, Y.: Electron localizability indicator for correlated wavefunctions. II Antiparallel-spin pairs. Theoretical Chemistry Accounts 113 (5), pp. 287 - 293 (2005)
2004
Journal Article
Dashjav, E.; Kreiner, G.; Schnelle, W.; Wagner, F. R.; Kniep, R.: Carbomolybdate(III): Zur Kenntnis von Pr2[Mo2C3] sowie Strukturbeziehungen zu Er2Mo2C3. Zeitschrift für Anorganische und Allgemeine Chemie 630 (13-14), pp. 2277 - 2286 (2004)
Journal Article
Dashjav, E.; Kreiner, G.; Schnelle, W.; Wagner, F. R.; Kniep, R.: Carbometallate: Komplexe Anionenverbände 2[MoC4/26-] in der Kristallstruktur von Pr2III[(MoCIIC2]. Zeitschrift für Anorganische und Allgemeine Chemie 630 (5), pp. 689 - 696 (2004)
Journal Article
Dashjav, E.; Kreiner, G.; Wagner, F. R.; Kniep, R.: Die Kristallstruktur von Pr2[Mo2C3] - Ein Carbomolybdat(III). Zeitschrift für Kristallographie (Supplement) 21, p. 152 - 152 (2004)
Journal Article
Dashjav, E.; Kreiner, G.; Wagner, F. R.; Schnelle, W.; Kniep, R.: Neue Carbometallate im Pr2[MoC2]-Strukturtyp. Zeitschrift für Anorganische und Allgemeine Chemie 630, p. 1716 - 1716 (2004)
Journal Article
Kirchner, M.; Wagner, F. R.; Schnelle, W.; Niewa, R.: Beiträge zur Verbindungsbildung im System Ca-In-N. Zeitschrift für Anorganische und Allgemeine Chemie 630, p. 1735 - 1735 (2004)
Journal Article
Kohout, M.; Pernal, K.; Wagner, F. R.; Grin, Y.: Electron localizability indicator for correlated wavefunctions. I. Parallel-spin pairs. Theoretical Chemistry Accounts 112 (5-6), pp. 453 - 459 (2004)
Journal Article
Niewa, R.; Zherebtsov, D. A.; Schnelle, W.; Wagner, F. R.: Metal-Metal Bonding in ScTaN2. A New Compound in the System ScN-TaN. Inorganic Chemistry 43 (20), pp. 6188 - 6194 (2004)
Journal Article
Novák, P.; Wagner, F. R.: Electronic structure and magnetism of 3d metal substituted Li3N. Journal of Magnetism and Magnetic Materials (Supplement) 272-276, pp. e269 - e270 (2004)
Journal Article
Schnelle, W.; Niewa, R.; Wagner, F. R.: Magnetic and electronic properties of lithium nitridometalates Li2[(Li1-xTx)N] (T = Co, Ni, Cu). Journal of Magnetism and Magnetic Materials 272-276, pp. 828 - 829 (2004)
2003
Journal Article
Kirchner, M.; Schnelle, W.; Wagner, F. R.; Niewa, R.: Preparation, crystal structure and physical properties of ternary compounds (R3N)In, R = rare-earth metal. Solid State Sciences 5 (9), pp. 1247 - 1257 (2003)
Journal Article
Novák, P.; Kuneš, J.; Pickett, W. E.; Ku, W.; Wagner, F. R.: Self-interaction correction and contact hyperfine field. Physical Review B 67, pp. 140403-1 - 1404034 (2003)
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