6 citations · 14 across the 7 of their papers we have counts for
7 papers
Multiplet structure of chromium(III) dopants in wide band gap materials
Ilya Popov, Petros-Panagis Filippatos, Shayantan Chaudhuri +3
Transition metal doping is commonly used for altering the properties of solid-state materials to suit applications in science and technology. Partially filled -shells of transit…
Efficient magnetic superstructure optimization with
Evgeny A. Plekhanov, Andrei L. Tchougréeff
Simulating the incommensurate spin density waves (ISDW) states is not a simple task within the standard \emph{ab-initio} methods. Moreover, in the context of new material discovery…
Calculating Bardeen-Cooper-Schrieffer and Magnetic Superstructure Electronic States with
Evgeny Plekhanov, Andrei Tchougréeff, Richard Dronskowski
We propose the (Theta-Phi) package which addresses two of the most important extensions of the essentially single-particle mean-field paradigm of the computational solid state…
c-a-ca Mean Field RVB Model of CuNCN Physics. Structure Manifestations of the RVB Transitions
A. L. Tchougréeff, R. Dronskowski
We propose a new form of the frustrated Heisenberg antiferromagnetic Hamiltonian with spatially anisotropic exchange parameters Jc, Ja, and Jac extended along the c, a, and a +/- c…
Tentative Structural Features of a Gapped RVB State in the Anisotropic Triangular Lattice
A. L. Tchougréeff, R. Dronskowski
The self-consistency equations for the independent order parameters as well as the free energy expression for the mean-field RVB model of the spin-1/2 Heisenberg Hamiltonian on the…
On the Properties of the Longitudinal RVB State in the Anisotropic Triangular Lattice. Mean-Field RVB Analytical Results
A. L. Tchougréeff, R. Dronskowski
The spin-1/2 Heisenberg model on an anisotropic triangular lattice is considered in the mean-field RVB approximation. The analytical estimates for the critical temperatures of the…