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Proton ordering in water ice is a paradigmatic order-disorder transition in a locally constrained system. The ice rules require exactly two hydrogens close to each oxygen, restricting the disorder to an exponentially large yet strongly…

Materials Science · Physics 2026-03-11 Qi Zhang , Sicong Wan , Lei Wang

We present a first-principles-based (second-principles) scheme that permits large-scale materials simulations including both atomic and electronic degrees of freedom on the same footing. The method is based on a predictive…

Materials Science · Physics 2016-06-08 Pablo García-Fernández , Jacek C. Wojdeł , Jorge Íñiguez , Javier Junquera

In this paper, we propose a method for numerical modeling of the nuclear matter properties within the framework of relativistic heavy-ion collisions using a holographic equation of state. Machine learning methods were applied to address the…

Nuclear Theory · Physics 2026-02-03 A. V. Anufriev , V. N. Kovalenko

We construct the equation of state (EoS) for neutron stars explicitly including hyperons and quarks. Using the quark-meson coupling model with relativistic Hartree-Fock approximation, the EoS for hadronic matter is derived by taking into…

Nuclear Theory · Physics 2015-12-01 Tsuyoshi Miyatsu , Myung-Ki Cheoun , Koichi Saito

First-principles alloy theory is used to establish the $\gamma$-surface of Fe-Cr-Ni alloys as function of chemical composition and temperature. The theoretical stacking fault energy (SFE) versus chemistry and temperature trends agree well…

Materials Science · Physics 2016-03-23 Wei Li , Song Lu , Dongyoo Kim , Se Kyun Kwon , Kalevi Kokko , Levente Vitos

We present an updated and improved equation of state (which we call the NDL EoS) for use in neutron-star structure and supernova simulations. This EoS is based upon a framework originally developed by Bowers & Wilson, but there are numerous…

High Energy Astrophysical Phenomena · Physics 2013-03-04 Matthew Meixner , J. Pocahontas Olson , Grant Mathews , N. Q. Lan , H. E. Dalhed

Observations of massive ($M \approx 2.0~M_\odot$) neutron stars (NSs), PSRs J1614-2230 and J0348+0432, rule out most of the models of nucleon-hyperon matter employed in NS simulations. Here we construct three possible models of…

High Energy Astrophysical Phenomena · Physics 2014-03-05 M. E. Gusakov , P. Haensel , E. M. Kantor

In this work, we extract the QCD Equation of State (EoS) using experimental results of the $\phi$ meson produced in nuclear collisions at AGS, SPS and RHIC energies. The data are confronted to simple thermodynamic expectations and lattice…

High Energy Physics - Phenomenology · Physics 2010-01-07 Raghunath Sahoo , Tapan K. Nayak , Jan-e Alam , Sonia Kabana , Basanta K. Nandi , Durga P. Mahapatra

We find that an equation of state for hot hadronic matter consisting of all baryons having $M < 2$ GeV and all mesons having $M < 1.5$ GeV, along with Hagedorn resonances in thermal and chemical equilibrium, matches rather smoothly with…

Nuclear Theory · Physics 2011-11-10 Somnath De , Dinesh K. Srivastava , Rupa Chatterjee

Thermophysical properties of hydrogen, helium, and hydrogen-helium mixtures have been investigated in the warm dense matter regime at electron number densities ranging from $6.02\times10^{29}\sim2.41\times10^{30}$/m$^{3}$ and temperatures…

Materials Science · Physics 2015-06-16 Cong Wang , Xian-Tu He , Ping Zhang

We investigate the properties of nuclear matter at the first-order phase transitions such as liquid-gas phase transition and hadron-quark phase transition. As a general feature of the first-order phase transitions of matter consisting of…

Nuclear Theory · Physics 2011-03-10 Toshiki Maruyama , Nobutoshi Yasutake , Toshitaka Tatsumi

A consistent Hartree-Fock study of the equation of state (EOS) of asymmetric nuclear matter at finite temperature has been performed using realistic choices of the effective, density dependent nucleon-nucleon (NN) interaction, which were…

Nuclear Theory · Physics 2016-03-30 Ngo Hai Tan , Doan Thi Loan , Dao T. Khoa , Jerome Margueron

High-fidelity simulations are essential for predicting material behavior under high-velocity impact (HVI), but their accuracy depends on material models and parameters that are often calibrated by manual fitting to multiple costly…

Materials Science · Physics 2026-04-01 Rong Jin , Guangyao Wang , Xingsheng Sun

Despite of their success, the results of first-principles quantum mechanical calculations contain inherent numerical errors caused by various approximations. We propose here a neural-network algorithm to greatly reduce these inherent…

Data Analysis, Statistics and Probability · Physics 2007-05-23 LiHong Hu , XiuJun Wang , LaiHo Wong , GuanHua Chen

In this work we calculate the thermodynamic properties of hydrogen-helium plasmas with different mass fractions of helium by the direct path integral Monte Carlo method. To avoid unphysical approximations we use the path integral…

Plasma Physics · Physics 2009-11-11 P. R. Levashov , V. S. Filinov , M. Bonitz , V. E. Fortov

We investigate the properties of nuclear matter at the first-order phase transitions (FOPT) such as liquid-gas phase transition, kaon condensation, and hadron-quark phase transition. As a general feature of the FOPT of matter consisting of…

Nuclear Theory · Physics 2009-05-12 Toshiki Maruyama , Toshitaka Tatsumi , Satoshi Chiba

In ultrarelativistic heavy-ion collisions, a plasma of deconfined quarks and gluons is formed within $1$ fm/c of the nuclei's impact. The complex dynamics of the collision before $\approx 1$ fm/c is often described with parametric models,…

Nuclear Theory · Physics 2024-06-24 Matthew R. Heffernan , Charles Gale , Sangyong Jeon , Jean-François Paquet

According to Wick's theorem, the second order self-energy corrections of hadrons in the hot and dense nuclear matter are calculated. Furthermore, the Feynman rules are summarized, and an effective formulation on quantum hadrodynamics at…

Nuclear Theory · Physics 2007-05-23 Bao-Xi Sun , Xiao-Fu Lu , Lei Li , Ping-Zhi Ning , Peng-Nian Shen , En-Guang Zhao

We study the equation of state (EOS) of nuclear matter at subnuclear density in a Virial expansion for a nonideal gas. The gas consists of neutrons, protons, alpha particles, and 8980 species of nuclei with $A \ge 12$ and masses from the…

Nuclear Theory · Physics 2010-10-27 G. Shen , C. J. Horowitz , S. Teige

The initial conditions in heavy-ion collisions are calculated in many different frameworks. The importance of nucleon position fluctuations within the nucleus and sub-nucleon structure has been established when modeling initial conditions…

Nuclear Theory · Physics 2021-02-17 R. Snyder , M. Byres , S. H. Lim , J. L. Nagle