Abstract
A Monte Carlo method with genetic algorithms (GAs) has been applied to calculate the magnetization and susceptibility of randomly generated spin clusters and α-HQNN organic radical crystal by using the Jab values calculated by ab initio molecular orbital methods. In the present GA method, the Ising model is considered and fitness parameters F(x) of the individuals are defined in terms of the energies given by the Ising Hamiltonian. Extensions of GA to treat the problem of molecular recognition, the Heisenberg model, and quantum spin systems are discussed. © 2000 John Wiley & Sons, Inc. Int J Quant Chem 80: 646–656, 2000
Sign-in/Register to access full text options 
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a callDisclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.
