3 papers
physics.chem-ph2012
Quantum Mechanical Results Of The Matrix Elements Of The Boltzmann Operator Obtained From Series Representations
Mahir E. Ocak
Recently developed series representations of the Boltzmann operator are used to obtain Quantum Mechanical results for the matrix elements, <x| exp(-β H)|x>, of the imaginary time p…
physics.chem-ph2012
Monomer Basis Representation Method For Calculating The Spectra Of Molecular Clusters II. Application To Water Dimer
Mahir E. Ocak
The Monomer Basis Representation (MBR) method developed in the first paper is applied to water dimer in order to illustrate its application and to show its validity. The calculatio…
physics.chem-ph2012
Monomer Basis Representation Method For Calculating The Spectra Of Molecular Clusters I. The Method And Qualitative Models
Mahir E. Ocak
Firstly, a sequential symmetry adaptation procedure is derived for semidirect product groups. Then, this sequential symmetry adaptation procedure is used in the development of new…