Publications by authors named "Russell M Pitzer"

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COLUMBUS─An Efficient and General Program Package for Ground and Excited State Computations Including Spin-Orbit Couplings and Dynamics.
Felix Plasser, Hans Lischka, Ron Shepard, Péter G Szalay, Russell M Pitzer

J Phys Chem A· July 2025

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The generality of the GUGA MRCI approach in COLUMBUS for treating complex quantum chemistry.
Hans Lischka, Ron Shepard, Thomas Müller, Péter G Szalay, Russell M Pitzer

J Chem Phys· April 2020

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Electronic spectrum of the UO and UO(+) molecules.
Rajni Tyagi, Zhiyong Zhang, Russell M Pitzer

J Phys Chem A· December 2014

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Early Experiences with Computational Quantum Chemistry.
Russell M Pitzer

J Chem Theory Comput· August 2011

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Theoretical investigations of the time-resolved photodissociation dynamics of IBr(-).
Samantha Horvath, Russell M Pitzer, Anne B McCoy

J Phys Chem A· October 2010

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Resonant X-ray enhancement of the Auger effect in high-Z atoms, molecules, and nanoparticles: potential biomedical applications.
Anil K Pradhan, Sultana N Nahar, Maximiliano Montenegro, Yan Yu, H L Zhang, Russell M Pitzer

J Phys Chem A· November 2009

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Assessment of the accuracy of shape-consistent relativistic effective core potentials using multireference spin-orbit configuration interaction singles and doubles calculations of the ground and low-lying excited states of U(4+) and U(5+).
Eric V Beck, Scott R Brozell, Jean-Philippe Blaudeau, Larry W Burggraf, Russell M Pitzer

J Phys Chem A· November 2009

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Jahn-Teller and related effects in the silver trimer. I. The ab initio calculation of spectroscopically observable parameters for the X 2E' and A 2E" electronic states.
Ilias Sioutis, Vadim L Stakhursky, Russell M Pitzer, Terry A Miller

J Chem Phys· March 2007

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Jahn-Teller and related effects in the silver trimer. II: vibrational analysis of the A 2E"-X 2E' electronic transition.
Ilias Sioutis, Vadim L Stakhursky, Russell M Pitzer, Terry A Miller

J Chem Phys· March 2007

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Theoretical investigation of the binding energies of the iodide ion and xenon atom with decaborane.
Ilias Sioutis, Russell M Pitzer

J Phys Chem A· November 2006

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Oxidation of gas-phase protactinium ions, Pa+ and Pa2+: formation and properties of PaO2(2+)(g), protactinyl.
Marta Santos, António Pires de Matos, Joaquim Marçalo, John K Gibson, Richard G Haire, Russell M Pitzer

J Phys Chem A· May 2006

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