WebJun 30, 1995 · ELSEVIER 30 June 1995 Chemical Physics Letters 240 (1995) 330-333 CHEMICAL PHYSICS LETTERS THz reflection spectroscopy of liquid water L. Thrane, R.H. Jacobsen, P. Uhd Jepsen, S.R. Keiding Kemisk Institut, Aarhus Universitet, Langelandsgade 140, DK-8000 Aarhus C, Denmark Received 11 January 1995; in final … WebThe Journal of Physical Chemistry Letters is a leader in its field: Ranked #1 Physical Chemistry journal and #8 Chemical & Material Science (general) journal*. h5-index: 127; h5-median: 193*. #3 in Physics, Atomic, Molecular & Chemical; #28 in Nanoscience & Nanotechnology; #35 in Chemistry, Physical; 53 in Materials Science, Multidisciplinary**.
Chemical Physics Letters - Journal - Elsevier
WebJan 20, 1995 · 20 January 1995 CHEMICAL PHYSICS LETTERS ELSEVIER Chemical Physics Letters 232 (1995) 379-382 Molecular transport in subnanometer pores: zero-point energy, reduced dimensionality and quantum sieving J.J.M. Beenakker, V.D. Borman 1, S.Yu. Krylov 1 Huygens Laboratory, Leiden University, P.O. Box 9504, 2300 … WebJul 21, 2004 · Chemical Physics Letters. Volume 393, Issues 1–3, 21 July 2004, Pages 51-57. ... [J. Chem. Phys., in press]. We demonstrate that CAM-B3LYP yields atomization energies of similar quality to those from B3LYP, while also performing well for charge transfer excitations in a dipeptide model, which B3LYP underestimates enormously. ... genpact mumbai office
The Journal of Physical Chemistry Letters
WebDec 3, 1999 · Theory. In Section 2, we review time-dependent response theory 4, 14 for the purpose of defining the TDDFT/TDA method and of clarifying the nature of the approximation assumed in this method. We start with the following time-dependent Kohn–Sham (KS) equation (1) ∑ q F pqσ P qrσ −P pqσ F qrσ =i ∂ P prσ ∂ t, with the idem … WebNov 20, 1992 · Volume 199, number 6 CHEMICAL PHYSICS LETTERS 20 November 1992 John A. Pople, Peter M.W. Gill and Benny G. Johnson Department of Chemistry, Carnegie Mellon University, Pittsburgh, PA 15312, USA Received 3August1992; in final form 14 September 1992 The Kohe Sham self-consistent equations, uollig a finite orbita.l basis … genpact microsoft partner