Nanofluids are obtained by suspending metallic nanoparticles in conventional base liquids.
Such a new class of heat‐transfer fluid is superior to the base liquids in energy‐transport …

The ab-initio density matrix renormalization group (DMRG) is a tool that can be applied to a
wide variety of interesting problems in quantum chemistry. Here, we examine the density …

Computation of lattice energies to an accuracy sufficient to distinguish polymorphs is a
fundamental bottleneck in crystal structure prediction. For the lattice energy of the …

Artificial Z (S)-scheme photocatalytic water splitting systems have attracted extensive
attention due to their advantages such as wide light absorption range, high charge …

Abstract As coronavirus disease 2019 (COVID-19) pandemic poses a substantial global
public health threat, traditional Chinese medicine (TCM) was used in 91.50% of the COVID …

The strongly contracted variant of second-order N-electron valence state perturbation theory
(NEVPT2) is an efficient perturbative method to treat dynamic correlation without the …

It is particularly important to investigate the structure–activity relationships between the
catalytic active sites and the catalytic activity. Molybdenum sulfide has been widely studied …

We describe and extend the formalism of state-specific analytic density matrix
renormalization group (DMRG) energy gradients, first used by Liu et al.[J. Chem. Theor …

Background This study aims to investigate the effects of inhibiting microRNA-9-5p (miR-9-
5p) on the expression of StAR-related lipid transfer domain containing 13 (StarD13) and the …

In the industrial design industry, innovation and entrepreneurship made by professional and
technical talents will become an important trend in the future development of the economy …