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Capturing transient electronic and molecular structures in liquids by picosecond X-ray absorption spectroscopy Gawelda, W.; Pham, V.T.; Nahhas, A. El; Kaiser, M.; ... Chergui, M. 2007
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Density functional theory with an approximate kinetic energy functional applied to study structure and stability of weak van der Waals complexes Wesolowski, Tomasz Adam; Ellinger, Yves; Weber, Jacques 1998
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High-spin -> low-spin relaxation in [Zn1-xFex(6-mepy)3-y(py)ytren](PF6)2 Schenker, Sabine; Hauser, Andreas; Wang, Wei; Chan, I. Y. 1998
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Hot recombination of photogenerated ion pairs Gladkikh, Vladislav; Burshtein, Anatoly I.; Feskov, Serguei V.; Ivanov, Anatoly I.; Vauthey, Eric 2005
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Interaction energies in hydrogen-bonded systems: A testing ground for subsystem formulation of density-functional theory Kevorkyants, Ruslan; Dulak, Marcin; Wesolowski, Tomasz Adam 2006
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Intramolecular motion in the triptycenegermanyl radical: single crystal EPR study at variable temperature and DFT calculations Brynda, Marcin; Dutan, Elena Cosmina; Berclaz, Théo; Geoffroy, Michel; Bernardinelli, Gérald Hugues 2003
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The merits of the frozen-density embedding scheme to model solvatochromic shifts Neugebauer, Johannes; Louwerse, Manuel J.; Baerends, Evert J.; Wesolowski, Tomasz Adam 2005