Search Results - "Friese, Daniel H"
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Pyrrolo[3,2-b]pyrroles-From Unprecedented Solvatofluorochromism to Two-Photon Absorption
Published in Chemistry : a European journal (07-12-2015)“…A combined experimental and theoretical study of the two‐photon absorption (2PA) properties of a series of quadrupolar molecules possessing a highly…”
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Intermolecular charge transfer enhances two-photon absorption in yellow fluorescent protein
Published in Physical chemistry chemical physics : PCCP (01-01-2014)“…We present a quantum chemical study of the two-photon absorption (TPA) properties of yellow fluorescent protein (YFP), a mutant of the extensively studied…”
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Five-Photon Absorption and Selective Enhancement of Multiphoton Absorption Processes
Published in ACS photonics (20-05-2015)“…We study one-, two-, three-, four-, and five-photon absorption of three centrosymmetric molecules using density functional theory. These calculations are the…”
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Electron-Rich Dipyrrolonaphthyridinediones: Synthesis and Optical Properties
Published in Journal of organic chemistry (05-10-2018)“…This article describes the design rationale for highly electron-rich dipyrrolonaphthyridinedione (DPND) derivatives bearing substituted amino groups at the 3…”
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Open-Ended Recursive Approach for the Calculation of Multiphoton Absorption Matrix Elements
Published in Journal of chemical theory and computation (10-03-2015)“…We present an implementation of single residues for response functions to arbitrary order using a recursive approach. Explicit expressions in terms of…”
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Open-Ended Recursive Calculation of Single Residues of Response Functions for Perturbation-Dependent Basis Sets
Published in Journal of chemical theory and computation (13-10-2015)“…We present theory, implementation, and applications of a recursive scheme for the calculation of single residues of response functions that can treat…”
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Analytic Molecular Hessian Calculations for CC2 and MP2 Combined with the Resolution of Identity Approximation
Published in Journal of chemical theory and computation (12-03-2013)“…An implementation of analytic second derivatives for the approximate coupled cluster singles and doubles model CC2 and for second-order Møller–Plesset…”
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Oxidation of 2-Propanol by Peroxo Titanium Complexes: A Combined Experimental and Theoretical Study
Published in Journal of physical chemistry. C (18-11-2010)“…The oxidation of 2-propanol by titanium peroxo complexes is investigated in a combined synthetic, spectroscopic, and computational study. We find in quantum…”
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Trithiatetrazocine Cations, [RCN4S3]+; Planar Sulfur−Nitrogen 10π Aromatics
Published in Inorganic chemistry (17-11-2008)“…The reaction of bicyclic sulfur−nitrogen heterocyles RCN5S3 (R = F3C, Ph, Me2N, 2-FC6H4, 2,6-F2C6H3) with [Hg(SO2)2][AsF6]2 in liquid SO2 yielded the…”
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Trithiatetrazocine cations, [RCN4S3]+; planar sulfur-nitrogen 10pi aromatics
Published in Inorganic chemistry (17-11-2008)“…The reaction of bicyclic sulfur-nitrogen heterocyles RCN 5S 3 (R = F 3C, Ph, Me 2N, 2-FC 6H 4, 2,6-F 2C 6H 3) with [Hg(SO 2) 2][AsF 6] 2 in liquid SO 2 yielded…”
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