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Ortiz Quantum Chemistry Group

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Publications of J. V. Ortiz

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2000

J. V. Ortiz*, Energy Gradients and Effective Density Differences in Electron Propagator Theory, J. Chem. Phys. 112, 56-68 (2000).
Request reprint. Copyright 2000 American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics.

O. Dolgounitcheva, V. G. Zakrzewski, and J. V. Ortiz*, Electron Propagator Calculations on Uracil and Adenine Ionization Energies, Int. J. Quant. Chem. 80, 831-35 (2000). Request reprint. DOI:10.1002/1097-461X(2000)80:4/5<831::AID-QUA31>3.0.CO;2-W

V. G. Zakrzewski, O. Dolgounitcheva, and J. V. Ortiz*, Efficient Electron Propagator Algorithms for Shakeup Final States: Anthracene and Acridine, Int. J. Quant. Chem. 80, 836-41 (2000). Request reprint. DOI:10.1002/1097-461X(2000)80:4/5<836::AID-QUA32>3.0.CO;2-O

O. Dolgounitcheva, V. G. Zakrzewski, and J. V. Ortiz*, Vertical Ionization Energies of Naphthalene, J. Phys. Chem. A 104, 10032-4 (2000).
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J. V. Ortiz*, Electron Propagator Theory of the Photoelectron Spectrum of Methanesulfenic Acid, J. Phys. Chem. A 104, 11433-8 (2000).
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O. Dolgounitcheva, V. G. Zakrzewski, and J. V. Ortiz*, Electron Propagator Theory of Guanine and Its Cations: Tautomerism and Photoelectron Spectra, J. Am. Chem. Soc. 122, 12304-9 (2000).
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J. M. Herbert and J. V. Ortiz*, Ab Initio Investigation of Electron Detachment in Dicarboxylate Dianions, J. Phys. Chem. A 104, 11786-95 (2000).
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H. Hopper, M. Lococo, O. Dolgounitcheva, V. G. Zakrzewski, and J. V. Ortiz*, Double-Rydberg Anions: Predictions on NH3AHn- and OH2AHn- Structures, J. Am. Chem. Soc. 122, 12813-8 (2000).
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