Energy-adjustedab initio pseudopotentials for the second and third row transition elements D Andrae, U Haeussermann, M Dolg, H Stoll, H Preuss
Theoretica chimica acta 77, 123-141, 1990
9428 1990 Accuracy of energy-adjusted quasirelativistic ab initio pseudopotentials: All-electron and pseudopotential benchmark calculations for Hg, HgH and their cations U Häussermann, M Dolg, H Stoll, H Preuss, P Schwerdtfeger, RM Pitzer
Molecular Physics 78 (5), 1211-1224, 1993
536 1993 Structural analysis of highly porous γ-Al2O3 L Samain, A Jaworski, M Edén, DM Ladd, DK Seo, FJ Garcia-Garcia, ...
Journal of Solid State Chemistry 217, 1-8, 2014
346 2014 The structure of α-Zn4Sb3: ordering of the phonon-glass thermoelectric material β-Zn4Sb3 J Nylén, M Andersson, S Lidin, U Häussermann
Journal of the American Chemical Society 126 (50), 16306-16307, 2004
159 2004 Structure and bonding properties of stacks by first-principles density functional theory H Lind, S Lidin, U Häussermann
Physical Review B—Condensed Matter and Materials Physics 72 (18), 184101, 2005
137 2005 Bonding and stability of the hydrogen storage material Mg2NiH4 U Häussermann, H Blomqvist, D Noréus
Inorganic chemistry 41 (14), 3684-3692, 2002
133 2002 Structural relationships, phase stability and bonding of compounds PdSnn (n= 2, 3, 4) J Nylén, FJG Garcıa, BD Mosel, R Pöttgen, U Häussermann
Solid state sciences 6 (1), 147-155, 2004
132 2004 FeGa3 and RuGa3: semiconducting intermetallic compounds U Häussermann, M Boström, P Viklund, Ö Rapp, T Björnängen
Journal of Solid State Chemistry 165 (1), 94-99, 2002
126 2002 Metal-nonmetal transition in the boron group elements U Häussermann, SI Simak, R Ahuja, B Johansson
Physical review letters 90 (6), 065701, 2003
116 2003 The s− p Bonded Representatives of the Prominent BaAl4 Structure Type: A Case Study on Structural Stability of Polar Intermetallic Network Structures U Häussermann, S Amerioun, L Eriksson, CS Lee, GJ Miller
Journal of the American Chemical Society 124 (16), 4371-4383, 2002
106 2002 Report from the third workshop on future directions of solid-state chemistry: The status of solid-state chemistry and its impact in the physical sciences MG Kanatzidis, KR Poeppelmeier, S Bobev, AM Guloy, SJ Hwu, ...
Progress in Solid State Chemistry 36 (1-2), 1-133, 2008
105 2008 Structure and bonding of Zinc Antimonides: Complex frameworks and narrow band gaps AS Mikhaylushkin, J Nylén, U Häussermann
Chemistry–A European Journal 11 (17), 4912-4920, 2005
103 2005 Low-Temperature Structural Transitions in the Phonon-Glass Thermoelectric Material β-Zn4 Sb3 : Ordering of Zn Interstitials and Defects J Nylén, S Lidin, M Andersson, BB Iversen, H Liu, N Newman, ...
Chemistry of Materials 19 (4), 834-838, 2007
96 2007 Localization of electrons in intermetallic phases containing aluminum U Häussermann, S Wengert, P Hofmann, A Savin, O Jepsen, R Nesper
Angewandte Chemie International Edition in English 33 (20), 2069-2073, 1994
88 1994 Thermal decomposition of ammonia borane at high pressures J Nylén, T Sato, E Soignard, JL Yarger, E Stoyanov, U Häussermann
The Journal of Chemical Physics 131 (10), 2009
85 2009 Laves-Phase Structural Changes in the System CaAl2-x Mg x S Amerioun, SI Simak, U Häussermann
Inorganic chemistry 42 (5), 1467-1474, 2003
85 2003 Comparative study of the high-pressure behavior of As, Sb, and Bi U Häussermann, K Söderberg, R Norrestam
Journal of the American Chemical Society 124 (51), 15359-15367, 2002
83 2002 Hydrides with the perovskite structure: general bonding and stability considerations and the new representative CaNiH3 T Sato, D Noréus, H Takeshita, U Häussermann
Journal of solid state chemistry 178 (11), 3381-3388, 2005
82 2005 Structural properties and superconductivity in the ternary intermetallic compounds ( , Sr, Ba; , Ga, In; , Ge, Sn) MJ Evans, Y Wu, VF Kranak, N Newman, A Reller, FJ Garcia-Garcia, ...
Physical Review B—Condensed Matter and Materials Physics 80 (6), 064514, 2009
75 2009 Effect of metal doping on the low-temperature structural behavior of thermoelectric β-Zn4Sb3 J Nylen, S Lidin, M Andersson, H Liu, N Newman, U Häussermann
Journal of Solid State Chemistry 180 (9), 2603-2615, 2007
72 2007