Publications of F. R. Wagner

Journal Article (95)

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)
Journal Article
Schnering, H. G. v.; Chang, J.-H.; Peters, K.; Wagner, F. R.; Grin, Y.; Thiele, G.: Structure and Bonding of the Hexameric Platinum(II) Dicloride, Pt6Cl12(β-PtCl2). Zeitschrift für Anorganische und Allgemeine Chemie 629, pp. 516 - 522 (2003)
2002
Journal Article
Kirchner, M.; Niewa, R.; Schnelle, W.; Wagner, F. R.; Walther, D.; Kniep, R.: Seltenerdnitride des Indiums (R3N)In. Zeitschrift für Anorganische und Allgemeine Chemie 628, p. 2202 - 2202 (2002)
Journal Article
Klatyk, J.; Schnelle, W.; Wagner, F. R.; Niewa, R.; Novak, P.; Kniep, R.; Waldeck, M.; Ksenofontov, V.; Gütlich, P.: Large Orbital Moments and Internal Magnetic Fields in Lithium Nitridoferrate(I). Physical Review Letters 88 (20), 207202, p. 207202 - 207202 (2002)
Journal Article
Kohout, M.; Wagner, F. R.; Grin, Y.: Electron localization function for transition-metal compounds. Theoretical Chemistry Accounts 108 (3), pp. 150 - 156 (2002)
Journal Article
Novák, P.; Wagner, F. R.: Electronic structure of lithium nitridoferrate: Effects of correlation and spin-orbit coupling. Physical Review B 66 (18), 184434, p. 184434 - 184434 (2002)
2001
Journal Article
Kohout, M.; Wagner, F. R.; Grin, Y.: Elektronen-Lokalisierungs-Funktion in Bindungen mit Übergangsmetall-Beteiligung. MPG Jahrbuch, pp. 617 - 619 (2001)
Journal Article
Niewa, R.; Schnelle, W.; Wagner, F. R.: Synthesis, Crystal Structure, and Physical Properties of (Ca3N)TI. Zeitschrift für Anorganische und Allgemeine Chemie 627, pp. 365 - 370 (2001)
Journal Article
Niewa, R.; Wagner, F. R.; Schnelle, W.; Hochrein, O.; Kniep, R.: Li24[MnN3]3N2 and Li5[(Li1-xMnx)N]3, Two Intermediates in the Decomposition Path of Li7[MnN4] to Li2[(Li1-xMnx)N]: An Experimental and Theoretical Study. Inorganic Chemistry 40, pp. 5215 - 5222 (2001)
Journal Article
Wagner, F. R.; Stöwe, K.: Electronic Band Structure of TlTe. Journal of Solid State Chemistry 157, pp. 193 - 205 (2001)

Book Chapter (3)

2023
Book Chapter
Wagner, F. R.; Grin, Y.: Chemical bonding analysis in position space. In: Comprehensive Inorganic Chemistry III: Theory and Bonding of Inorganic Nonmolecular Systems (Volume 3), Vol. Theory and Bonding of Inorganic Nonmolecular Systems (Volume 3), pp. 222 - 237 (Eds. Reedijk, J.; Poeppelmeier, K. R.). Elsevier, Amsterdam (2023)
2017
Book Chapter
Miller, G. J.; Zhang, Y.; Wagner, F. R.: Chemical Bonding in Solids. In: Handbook of Solid State Chemistry, Vol. 5, pp. 405 - 489 (Ed. Dronskowski, R.). Wiley-VCH, Weinheim (2017)
2016
Book Chapter
Bende, D.; Grin, Y.; Wagner, F. R.: Chemical bonding in MgAgAs-type compounds. In: Heusler Alloys, pp. 133 - 156 (Ed. Felser, C.). Springer, Cham (2016)
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