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Titlebook: Quantum Systems in Chemistry and Physics; Volume 1: Basic Prob Alfonso Hernández-Laguna,Jean Maruani,Stephen Wils Book 2000 Springer Scienc

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Electro-Nuclear Quantum Mechanics Beyond the Born-Oppenheimer Approximation. Towards a Quantum Elects nuclear configurations. The set of continuous and discrete symmetries, these latter related to a stationary nuclear configuration whenever it is the case, lay down the framework to bracket a Hilbert space describing the system. While the expectation value of the molecular hamiltonian (including th
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Modeling of the Reaction of Azathioprine with the Hydroxide Anionttack on the azathioprine molecule. DFT and ab-initio approaches have been applied to model the reaction of azathioprine with a simple nucleophile i.e. hydroxide anion. Quantum mechanical methods allowed to propose a detailed mechanism for the reaction of isolated molecule of azathioprine with hydro
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1567-7354 ystems in Chemistry and Physics, held in Granada (Spain), April 19–22, 1998. Ninety-nine scientists from Bulgaria, Columbia, Cuba, Denmark, Finland, France, Germany, Hungary, Israel, Italy, Mexico, Netherlands, Norway, Poland, Russia, Slovakia, Spain, Sweden, United Ki- dom, Uruguay and Venezuela at
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