Related papers: Externally corrected CCSD with renormalized pertur…
A mechanism of the quasi-one-dimensional (q1d) superconductivity is investigated by applying the renormalization group techniques to the pairing interaction. With the obtained renormalized pairing interaction, the transition temperature Tc…
Heavy atom compounds represent a challenge for computational chemistry, due to the need for simultaneous treatment of relativistic and correlation effects. Often such systems exhibit also strong correlation which hampers the application of…
The method of non-perturbative renormalization group (NPRG) is applied to the analysis of dynamical chiral symmetry breaking (DCSB) in QCD. We show that the DCSB solution of the NPRG flow equation can be obtained without the bosonization.…
The cluster-in-molecule (CIM) local correlation approach with an accurate distant pair correlation energy correction is presented. For large systems, the inclusion of distant pair correlation energies is essential for the accurate…
A novel approach to rapidly converging high-level coupled-cluster (CC) energetics in an automated fashion is proposed. The key idea is an adaptive selection of the excitation manifolds defining higher-than-two-body components of the cluster…
We develop a quartic-scaling implementation of coupled-cluster singles and doubles based on low-rank tensor hypercontraction (THC) factorizations of both the electron repulsion integrals (ERIs) and the doubles amplitudes. This extends our…
Using renormalization-group methods, differential equations can be obtained for the all-orders summation of leading and subsequent non-leading logarithmic corrections to QCD perturbative series for a number of processes and correlation…
The density matrix renormalization group (DMRG) is applied to some one-dimensional reaction-diffusion models in the vicinity of and at their critical point. The stochastic time evolution for these models is given in terms of a non-symmetric…
We propose a non-iterative, post hoc correction to the unitary coupled cluster theory with single, double, and triple excitations (UCCSDT) ansatz, which considers the leading-order effects of neglected quadruple excitations. We present two…
We present two efficient and intruder-free methods for treating dynamic correlation on top of general multi-configuration reference wave functions---including such as obtained by the density matrix renormalization group (DMRG) with large…
We present the formulation and implementation of triples correction scheme to the relativistic equation-of-motion coupled-cluster method for ionization potential. Both full and partial triples correction schemes are implemented using the…
The perturbative QCD static potential and ultrasoft contributions, which together give the static energy, have been calculated to three- and four-loop order respectively, by several authors. Using the renormalization group, and Pad\'e…
We present an implementation of equation of motion coupled-cluster singles and doubles (EOM-CCSD) theory using periodic boundary conditions and a plane wave basis set. Our implementation of EOM-CCSD theory is applied to study $F$-centers in…
We present a new method for renormalisation group improvement of the effective potential of a quantum field theory with an arbitrary number of scalar fields. The method amounts to solving the renormalisation group equation for the effective…
A coordinate space approach, based on that used by Efimov, is applied to three-body systems with contact interactions between pairs of particles. In systems with nonzero orbital angular momentum or with asymmetric spatial wave functions,…
We describe the use of coupled-cluster theory as an impurity solver in dynamical mean-field theory (DMFT) and its cluster extensions. We present numerical results at the level of coupled-cluster theory with single and double excitations…
Marine Controlled Source Electromagnetic (CSEM) is employed both in large-scale geophysical applications as well as within exploration of hydrocarbons and gas hydrates. Due to the diffusive character of the EM field only very low…
Cross-correlated contrast source inversion (CC-CSI) is a non-linear iterative inversion method that is proposed recently for solving the inverse scattering problems. In CC-CSI, a cross-correlated error is constructed and introduced to the…
We present the first implementation of a density matrix renormalization group algorithm embedded in an environment described by density functional theory. The frozen density embedding scheme is used with a freeze-and-thaw strategy for a…
We investigate the identification of the time-dependent source term in the diffusion equation using boundary measurements. This facilitates tracing back the origins of environmental pollutants. Employing the concept of dynamic complex…