Browsing "Faculty of Natural Sciences and Mathematics" by Subject hydroxide ion; ionic water solutions; solvation; hydrogen bonds; intermolecular interactions; anharmonic O–H vibrational frequency shifts; Monte-Carlo simulation; Fourier grid; Hamiltonian method; Numerov algorithm; diagonalization of Hamiltonian matrix
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| Preview | Title | Author(s) | Issue Date | Type |
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| Comparison of methods for solving the vibrational Schrödinger equation in the course of sequential Monte-Carlo-quantum mechanical treatment of hydroxide ion hydration | J. Petreska, Lj. Pejov | 22-Oct-2010 | Article |