Related papers: New phasing method based on the principle of minim…
We develop a method in which the electronic densities of small fragments determined by Kohn-Sham density functional theory (DFT) are embedded using stochastic DFT to form the exact density of the full system. The new method preserves the…
Sub-angstrom spatial resolution of electron density coupled with sub-femtosecond temporal resolution is required to directly observe the dynamics of the electronic structure of a molecule after photoinitiation or some other ultrafast…
An outstanding question in X-ray single particle imaging experiments has been the feasibility of imaging sub 10-nm-sized biomolecules under realistic experimental conditions where very few photons are expected to be measured in a single…
We provide an efficient method for computing the maximum likelihood mixed quantum state (with density matrix $\rho$) given a set of measurement outcome in a complete orthonormal operator basis subject to Gaussian noise. Our method works by…
A spectral decomposition method has been implemented to identify and quantify isotopic source terms in high-resolution gamma-ray spectroscopy in static geometry and shielding scenarios. Monte-Carlo simulations were used to build the…
For systems of $N$ charged fermions (e.g. electrons) interacting with longitudinal optical quantized lattice vibrations of a polar crystal we derive upper and lower bounds on the minimal energy within the model of H. Fr\"ohlich. The only…
Highly accurate experimental structure factors of silicon are available in the literature, and these provide the ideal test for any \emph{ab initio} method for the construction of the all-electron charge density. In a recent paper [J. R.…
Spectra of parametric X-ray radiation (PXR) are considered in the range of anomalous dispersion for one of the atoms in a crystal elementary cell. The PXR spectra are calculated both for the ultra-relativistic and non-relativistic electrons…
A process tomography based optimization scheme for open quantum systems is used to determine the performance limits of Josephson charge qubits within current experimental means. The qubit is modeled microscopically as an open quantum system…
The mesoscopic field theory for ionic systems [A. Ciach and G. Stell, J. Mol. Liq. 87, 255 (2000)] is extended to the system with charged boundaries. A very simple expression for the excess grand potential functional of the charge density…
We consider electron systems in quantum dots and imaging of the confined charge density by the Coulomb blockade microscopy (CBM) with the scanning probe technique. We apply an exact diagonalization method to study the reaction of the…
The perturbative approach for describing the underdense plasma--ultrarelativistic electron bunch system is developed, using the ratio $\frac{n_0}{n_b}$ as a small parameter ($n_b$--bunch,$n_0$--plasma electron densities). Focusing of the…
This paper proposes a novel phase identification method for distribution networks where phases can be severely unbalanced and insufficiently labeled. The analysis approach draws on data from high-precision phasor measurement units…
X-Ray Thomson Scattering (XRTS) is an important experimental technique used to measure the temperature, ionization state, structure, and density of warm dense matter (WDM). The fundamental property probed in these experiments is the…
Morphology of metal thin layers deposited on polished surfaces of LiNbO$_3$ crystal with dissimilar electric charges has been studied using various methods of vacuum evaporation. The principal goal of the work is to optimizemethods of thin…
Consider the electric field E about an electron. Its source has been thought a substance called charge, enclosed within a small volume that defines the size of the electron. Scattering experiments find no size at all. Charge is useful, but…
Several authors have suggested that the surfaces of vanishing potential generated by the electrostatic fields from a distribution of point charges resemble triply periodic minimal surfaces (TPMS) corresponding to the positions of the point…
Central idea: To obtain the interaction potential using the inverse scattering method, we have employed the Physics-Informed Machine Learning (PIML) approach. In this framework, the machine learning algorithm is guided by the underlying…
High-temperature superconductor $Bi_{2}Sr_{2}CaCu_{2}O_{8}+x$ has been investigated by the high-resolution electron microscope (HREM) and the photodensitometric technique in order to resolve the sub-atomic shifts in the modulated structure.…
The recently developed information-theoretic approach to crystallographic symmetry classifications and quantifications in two dimensions (2D) from digital transmission electron and scanning probe microscope images is adapted for the…