Lambrecht, Daniel S. - University of Pittsburgh

个人简介

Award for best PhD in Chemistry & Pharmacy, 2007 Kekulé PhD Fellowship, 2005-2007 Baden-Württemberg PhD Scholarship, 2003-2005 German Academic Exchange Service Fellowship at UNC-Chapel Hill, 2001-2002

研究领域

Theoretical and Computational Chemistry/Reduced Scaling and Efficient Approaches/Computational Catalysis

近期论文

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"Linear‐Scaling Methods in Quantum Chemistry," C. Ochsenfeld, J. Kussmann, and D. S. Lambrecht, Reviews in Computational Chemistry , Vol. 23, 2007, Pages 1-82, http://media.wiley.com/product_data/excerpt/11/04700820/0470082011.pdf "Rigorous integral screening for electron correlation methods," D. S. Lambrecht, B. Doser, and C. Ochsenfeld, J. Chem. Phys., Vol. 123, 2005, Pages 184102 , "A kinetic energy fitting metric for resolution of the identity second-order Møller-Plesset perturbation theory," Daniel S. Lambrecht, Kai Brandhorst, William H. Miller, C. William McCurdy, and Martin Head-Gordon, J. Phys. Chem. A, Vol. 115, 2011, Pages 2794 , "Higher order singular value decomposition in quantum chemistry," Franziska Bell, Daniel S. Lambrecht, and Martin Head-Gordon, Mol. Phys., Vol. 108, 2010, Pages 2759 , "Current Status of the AMOEBA Polarizable Force Field," J. W. Ponder, C. Wu, P. Ren, V. S. Pande, J. D. Chodera, M. J. Schnieders, I. Haque, D. L. Mobley, D. S. Lambrecht, R. A. Di Stasio, M. Head-Gordon, G. N. I. Clark, M. E. Johnson, and T. Head-Gordon, J. Phys. Chem. B, Vol. 114, 2010, Pages 2549, "Simulated photoelectron spectra of CN-(H2O) via quasiclassical molecular dynamics," Daniel S. Lambrecht, Gary N. I. Clark, Teresa Head-Gordon, and Martin Head-Gordon, J. Phys. Chem. A, Vol. 115, 2011, Pages 5928, "Charge-transfer and the hydrogen bond: Spectroscopic and structural implications from electronic structure calculations," E. Ramos-Cordoba, D. S. Lambrecht, and M. Head-Gordon, Faraday Discussions, Vol. 150, 2011, Pages 345 ,