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Using density functional theory and many-body perturbation theory within a GW approximation, we calculate the electronic structure of a metal-molecule interface consisting of benzene diamine (BDA) adsorbed on Au(111). Through direct…

材料科学 · 物理学 2011-11-29 Isaac Tamblyn , Pierre Darancet , Su Ying Quek , Stanimir A. Bonev , Jeffrey B. Neaton

We determine the adiabatic phase diagrams for a resonantly-coupled system of Fermi atoms and Bose molecules confined in a harmonic trap by using the local density approximation. The key idea of our work is conservation of entropy through…

其他凝聚态物理 · 物理学 2009-09-12 S. Watabe , T. Nikuni , N. Nygaard , J. E. Williams , C. W. Clark

For the repulsive Blume-Emery-Griffiths model the phase diagram in the space of three fields, temperature (T), crystal field ($\Delta$), and magnetic field (H), is computed on a complete graph, in the canonical and microcanonical ensembles.…

统计力学 · 物理学 2021-04-28 Soheli Mukherjee , Raj Kumar Sadhu , Sumedha

The spin-1 Ising (BEG) model with the nearest-neighbour bilinear and biquadratic interactions and single-ion anisotropy is simulated on a cellular automaton which improved from the Creutz cellular automaton(CCA) for a simple cubic lattice.…

统计力学 · 物理学 2009-11-11 N. Seferoglu , B. Kutlu

We determine the adiabatic phase diagram of a resonantly-coupled system of Fermi atoms and Bose molecules confined in the harmonic trap by using the local density approximation. The adiabatic phase diagram shows the fermionic condensate…

其他凝聚态物理 · 物理学 2009-11-11 S. Watabe , T. Nikuni , N. Nygaard , J. E. Williams , C. W. Clark

We calculate the phase diagrams for a harmonically trapped ideal gas mixture of fermionic atoms and bosonic molecules in chemical and thermal equilibrium, where the internal energy of the molecules can be adjusted relative to that of the…

统计力学 · 物理学 2009-11-10 J. E. Williams , N. Nygaard , C. W. Clark

Atomic structures and adatom geometries of surfaces encode information about the thermodynamics and kinetics of the processes that lead to their formation, and which can be captured by a generative physical model. Here we develop a workflow…

We study effects of higher-order antinematic interactions on the critical behavior of the antiferromagnetic (AFM) $XY$ model on a triangular lattice, using Monte Carlo simulations. The parameter $q$ of the generalized antinematic (ANq)…

统计力学 · 物理学 2021-09-01 M. Lach , M. Žukovič

We consider a mixture of a two-component Fermi gas and a single-component dipolar Bose gas in a square optical lattice and reduce it into an effective Fermi system where the Fermi-Fermi interaction includes the attractive interaction…

量子气体 · 物理学 2017-03-22 Jasen A. Scaramazza , Ben Kain , Hong Y. Ling

Studies in atomic-scale modeling of surface phase equilibria often focus on temperatures near zero Kelvin due to the challenges in calculating the free energy of surfaces at finite temperatures. The Bayesian-inference-based nested sampling…

材料科学 · 物理学 2024-04-23 Mingrui Yang , Livia B. Pártay , Robert B. Wexler

An Ising model with ferromagnetic nearest-neighbor interactions $J_{1}$ ($J_{1}>0$) and random next-nearest-neighbor interactions [$+J_{2}$ with probability $p$ and $-J_{2}$ with probability $(1-p)$; $J_{2}>0$] is studied within the…

统计力学 · 物理学 2009-06-22 Octavio R. Salmon , J. Ricardo de Sousa , Fernando D. Nobre

Accurate phase equilibria are foundational to alloy design because they encode the underlying thermodynamics governing stability, transformations, and processing windows. However, while the CALculation of Phase Diagrams (CALPHAD) provides a…

机器学习 · 计算机科学 2026-04-21 Eunjeong Park , Amrita Basak

We obtain the complete quantum phase diagram of bosons on a two-leg ladder in the presence of attractive onsite and repulsive interchain nearest-neighbor interactions by imposing the onsite three-body constraint. We find three distinct…

量子气体 · 物理学 2014-07-31 Manpreet Singh , Tapan Mishra , Ramesh V. Pai , B. P. Das

Under the Thomas-Fermi approximation, a relatively much simpler analytical solutions of the coupled Gross-Pitaevskii equations for the two-species BEC have been derived. Additionally, a model for the asymmetric states has been proposed, and…

原子物理 · 物理学 2017-07-12 Z. B. Li , Y. M. Liu , D. X. Yao , C. G. Bao

The superfluid phases in the resonant dipolar Fermi gases are investigated by the standard mean-field theory. In contrast to the crossover from Bose-Einstein condensation (BEC) to Bardeen-Cooper-Schrieffer (BCS) superfluid in the Fermi…

量子气体 · 物理学 2013-05-30 T. Shi , S. -H. Zou , H. Hu , C. -P. Sun , S. Yi

We derive the phase diagram of the one-dimensional three-state Potts model with an additional mean-field interaction in the canonical ensemble. The free energy is obtained by mapping the model onto the spin-$1$ Blume-Emery-Griffiths model…

统计力学 · 物理学 2026-02-24 Alessandro Campa , Vahan Hovhannisyan , Stefano Ruffo , Andrea Trombettoni

We calculate the dynamic phase transition (DPT) temperatures and present the dynamic phase diagrams in the Blume-Capel model under the presence of a time-dependent oscillating external magnetic field by using the path probability method. We…

统计力学 · 物理学 2015-06-15 Mehmet Ertas , Mustafa Keskin

We construct the complete $U$-$\mu$ phase diagram for harmonically confined ultracold fermionic atoms with repulsive and attractive interactions. ($\mu$ is the chemical potential and $U$ the interaction strength.) Our approach is based on…

强关联电子 · 物理学 2015-06-25 V. L. Campo , K. Capelle

The phase diagram of the attractive Hubbard model with spatially inhomogeneous interactions is obtained using a single site dynamical mean field theory like approach. The model is characterized by three parameters: the interaction strength,…

超导电性 · 物理学 2009-11-13 Vijay B. Shenoy

We study field-induced phase transitions in the two-dimensional dipolar Ising ferromagnet with a specific ratio between the exchange and dipolar constants, $\delta=1$, which exhibits a stripe-ordered phase with the width of one lattice unit…

统计力学 · 物理学 2018-12-26 Hisato Komatsu , Yoshihiko Nonomura , Masamichi Nishino
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