We review the history of the parallel tempering simulation method. From its origins in data analysis, the parallel tempering method has become a standard workhorse of physiochemical simulations. We discuss the theory behind the method and its various generalizations. We mention a selected set of the many applications that have become possible with the introduction of parallel tempering and we s...

cryogenic treatment can be used as a supplemental treatment that is performed on some tool steels between quenching and tempering as an effective method for decreasing retained austenite and increasing wear resistance. in this research, the effect of deep cryogenic treatment (dct) on dimensional stability and mechanical properties of 80crmo12 5 tool steel was investigated. the martensitic trans...

We review the history of the parallel tempering simulation method. From its origins in data analysis, the parallel tempering method has become a standard workhorse of physiochemical simulations. We discuss the theory behind the method and its various generalizations. We mention a selected set of the many applications that have become possible with the introduction of parallel tempering and we s...

We review the history of the parallel tempering simulation method. From its origins in data analysis, the parallel tempering method has become a standard workhorse of physiochemical simulations. We discuss the theory behind the method and its various generalizations. We mention a selected set of the many applications that have become possible with the introduction of parallel tempering and we s...

We review the history of the parallel tempering simulation method. From its origins in data analysis, the parallel tempering method has become a standard workhorse of physicochemical simulations. We discuss the theory behind the method and its various generalizations. We mention a selected set of the many applications that have become possible with the introduction of parallel tempering, and we...

We discuss multidimensional generalizations of multicanonical algorithm, simulated tempering, and replica-exchange method. We generalize the original potential-energy function E0 by adding any physical quantity V of interest as a new energy term with a coupling constant lambda. We then perform a multidimensional multicanonical simulation where a random walk in E0 and V spaces is realized. We ca...

The growing adoption of generalized-ensemble algorithms for biomolecular simulation has resulted in a resurgence in the use of the weighted histogram analysis method (WHAM) to make use of all data generated by these simulations. Unfortunately, the original presentation of WHAM by Kumar et al. is not directly applicable to data generated by these methods. WHAM was originally formulated to combin...

A strategy combining intercritical quenching, pre-tempering, and tempering processes was implemented to optimize the microstructures mechanical properties of 5CrNiMoV steel. By intercritically quenching at 1050 °C, pr-tempering 600 550 steel exhibited a comprehensive performance with yield strength 1120 MPa, an ultimate tensile 1230 elongation 8.2%. The high is attributed presence tempered mart...