Time-dependent restricted active space Configuration Interaction theory applied to the photoionization of neon
نویسندگان
چکیده
منابع مشابه
Rank-Restricted Full Configuration Interaction
which is a linear combination of n-electron configurations, or determinants, with coefficients equal to c!. The components |Φ! form an orthonormal basis of the wavefunction. The determinants are the set of features that comprise the wavefunction, so we can optimize them by minimizing the electronic energy. To determine the energy of the wavefunction c, the Schrödinger equation in matrix form reads
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ژورنال
عنوان ژورنال: Journal of Physics: Conference Series
سال: 2013
ISSN: 1742-6588,1742-6596
DOI: 10.1088/1742-6596/427/1/012007