all-electron configuration interaction calculationsWe present the results of relativistic and non-relativistic self-consistent field and configuration interaction calculations for the gold atom, using the spin-free no-pair Hamiltonian in a basis set expansion. A new basis set for the gold atom is ...
An electron configuration is an abbreviated form of the orbital diagram. The electron configuration for hydrogen would be 1s 1 . The coefficient 1 indicates that the sole electron occupies the first energy level, and the superscript 1 indicates that one electron occupies the s orbital within th...
Unfortunately, cobalt-60 decays back to stable nonradioactive nickel-60 at a rate of approximately 1% per month; therefore, the source is to be replenished by 12% annually. Gamma has high penetration capability and can sterilize nonuniform and high-density products in final packaging, ensuring ...
(a) Write the ground-state electron configuration for an arsenic atom, showing the number of electrons in each subshell. (b) Give one permissible set of four quantum numbers for each of the outermost electrons in a single As atom when it is in its ground state. ...
First-principles calculations of the interaction between hydrogen and 3d alloying atom in nickel Knowledge of the behavior of hydrogen (H) in Ni-based alloy is essential for the prediction of Tritium behavior in Molten Salt Reactor. First-principles ca... W Liu,Y Qian,D Zhang,... - 《Journ...
In contrast, the competition between the magnetically ordered phases depends mainly on the gaps in the Ni 3dx2Ày2 band. Our estimated value of the on-site Hubbard U in the nickelates is similar to that in the cuprates, but the value of the Hund's coupling JH is found to be ...
In this work, we present an approach that the E-beam focusing in gate-type cathodes can be achieved simply using a self-charging gate. Specifically, an electret material-based gate with SiNx/Au/Si structure is introduced. Notably, this configuration enables ultrahigh transmittance (~96%) without...
the active sites of single-atom Cu show the△GH∗close to zero for hydrogen evolution. A neighboring Cu SAC exhibits high water dissociation activity, significantly surpassing both isolated Cu SAC and Cu nanoclusters. When the Co atom is introduced, n-Cu/BP still shows a greater turnover ...
Write the ground state electron configuration for an arsenic atom, showing the number of electrons in each subshell (b) Give one permissible set of four quantum numbers for each of the outermost electrons in a single As atom when it is in its ground state. (c) Is an isolated arsenic...
which support a zero oxidation state for the nickel atom in these cluster complexes. These authors claimed that the Mo3 framework may be view as a tridentate π-acceptor metalloligand to the Ni(0) atom. Other investigations on the topic are in progress in our group. Acknowledgements Financial...