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The total conformational energy is assumed to consist of pairwise interaction energies between atoms or residues, each of which is expressed as a product of a conformation-dependent function (an element of a contact matrix, C-matrix) and a…

Biomolecules · Quantitative Biology 2011-09-01 Sanzo Miyazawa , Akira R. Kinjo

The expectation value of the Hamiltonian using a model wave function is widely used to estimate the eigenvalues of electronic Hamiltonians. We explore here a modified formula for models based on long-range interaction. It scales differently…

Chemical Physics · Physics 2024-06-13 Anthony Scemama , Andreas Savin

The BCS-BEC crossover in a lattice is a powerful paradigm to understand how a superconductor deviates from the Bardeen-Cooper-Schrieffer physics as the attractive interaction increases. Optical lattices loaded with binary mixtures of cold…

Strongly Correlated Electrons · Physics 2014-05-15 A. Amaricci , A. Privitera , M. Capone

Models play an important role in our understanding of the global structure of the solar wind and its interaction with the interstellar medium. A critical ingredient in many types of models are the charge-exchange collisions between ions and…

Solar and Stellar Astrophysics · Physics 2020-06-30 M. Bzowski , J. Heerikhuisen

Recent theoretical studies found that mixtures of active and passive colloidal particles phase separate but only at very high activity ratio. The high value poses serious obstacles for experimental exploration of this phenomenon. Here we…

Soft Condensed Matter · Physics 2017-03-08 Jan Smrek , Kurt Kremer

By this we extend our work of the year 1992 devoted to calculating the intrashell excitations in the d-shells of coordination compounds of the first transition metal row, which resulted in the Effective Hamiltonian Crystal Field (EHCF)…

Chemical Physics · Physics 2013-03-26 Andrei L. Tchougréeff

Eukaryotic DNA is packaged into chromatin: one-dimensional arrays of nucleosomes separated by stretches of linker DNA are folded into 30-nm chromatin fibers which in turn form higher-order structures. Each nucleosome, the fundamental unit…

Genomics · Quantitative Biology 2011-05-25 Răzvan V. Chereji , Alexandre V. Morozov

Despite a wealth of experimental data for high p_T processes in heavy-ion collisions, discriminating between different models of hard parton-medium interactions has been difficult. One important reason is that the pQCD parton spectrum at…

High Energy Physics - Phenomenology · Physics 2015-03-19 Thorsten Renk

The absence of screening of the non-local Coulomb interaction in Dirac systems at charge neutrality leads to the breakdown of the Fermi liquid and divergence of the Fermi velocity. On the other hand, Mott Hubbard physics and the concomitant…

Strongly Correlated Electrons · Physics 2025-01-07 Ho-Kin Tang , Indra Yudhistira , Udvas Chattopadhyay , Maksim Ulybyshev , P. Sengupta , F. F. Assaad , S. Adam

Estimating the effective energy, $E_\text{eff}$ of a stationary probability distribution is a challenge for non-equilibrium steady states. Its solution could offer a novel framework for describing and analyzing non-equilibrium systems. In…

Statistical Mechanics · Physics 2026-02-03 Antonin Brossollet , Etienne Lempereur , Stéphane Mallat , Giulio Biroli

We analyzed pattern formation and identified different phases in a system of particles interacting through a non-monotonic short-range repulsive (r<r_c) and long-range attractive (r>r_c) potential, using molecular-dynamics simulations.…

Soft Condensed Matter · Physics 2011-07-05 H. J. Zhao , V. R. Misko , F. M. Peeters

We present a systematic configuration-interaction shell model calculation on the structure of light tin isotopes with a new global optimized effective interaction. The starting point of the calculation is the realistic CD-Bonn…

Nuclear Theory · Physics 2012-10-19 Chong Qi , Z. X. Xu

The energy spectrum of two short-range interacting particles in a harmonic potential trap has previously been related to free-space scattering phase shifts. But the existing formula for this purpose is exact only in the limit of an…

Nuclear Theory · Physics 2020-05-20 Xilin Zhang

In a previous work (arXiv:2010.02027) we showed how the full configuration interaction (FCI) ground state energy can be obtained as a functional of an arbitrary reference wavefunction by means of a gradient descent or quasi-Newton…

Chemical Physics · Physics 2020-12-10 Carlos A. Jiménez-Hoyos

Inspired by our earlier semi-stochastic work aimed at converging high-level coupled-cluster (CC) energetics [J. E. Deustua, J. Shen, and P. Piecuch, Phys. Rev. Lett. 119, 223003 (2017); J. Chem. Phys. 154, 124103 (2021)], we propose a novel…

Chemical Physics · Physics 2022-10-06 Karthik Gururangan , J. Emiliano Deustua , Jun Shen , Piotr Piecuch

Effective interactions that fit the low energy p-$^3$He experimental data have been constructed. They are based on the Resonating Group Method and a modified Orthogonality Condition Model in which Pauli and partly Pauli forbidden states are…

Nuclear Theory · Physics 2007-05-23 S. Gojuki , S. Oryu , S. A. Sofianos

In this paper, the ionization and recombination coefficients of dense semiclassical hydrogen plasma on the basis of the effective interaction potential have been investigated. For this goal the Bohr$-$Lindhard method and method phase…

We study halo nuclei using a two-frequency shell-model approach employing wave functions of two different oscillator constants $\hbar\omega_{in}$ and $\hbar\omega_{out}$, the former for the inner orbits and the latter for the halo (outer)…

Nuclear Theory · Physics 2015-06-26 T. T. S. Kuo , H. Müther , K. Amir-Azimi-Nili

Nucleus-nucleus interaction potentials in heavy-ion fusion reactions are extracted from the microscopic time-dependent Hartree-Fock theory. When the center-of-mass energy is much higher than the Coulomb barrier energy, extracted potentials…

Nuclear Theory · Physics 2009-11-13 Kouhei Washiyama , Denis Lacroix

The experimental level structure of 134Sb is compared with the results of a shell-model calculation in which the two-body matrix elements of the effective interaction have been derived from the CD-Bonn nucleon-nucleon potential. The…

Nuclear Theory · Physics 2009-11-11 L. Coraggio , A. Covello , A. Gargano , N. Itaco
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