Related papers: First principles molecular dynamics simulation of …

This manuscript has been withdrawn by the author. Some of the material has been included in the manuscript 'Dualizing the Dual Standard Model' hep-ph/0102084.

This paper has been withdrawn by the authors because the wave packet propagation used in the ion-dynamics calculation did not allow for electron-nuclei correlation. Hence, the conclusion that the ion-dynamics model is not in agreement with…

This paper has been withdrawn by the authors.

This paper has been withdrawn.

This paper has been withdrawn by the authors because the paper is largely revised and improved.

This paper has been withdrawn by the author because of copyright reasons.

A first-principles approach for calculating ion separation in solution through two-dimensional (2D) membranes is proposed and applied. Ionic energy profiles across the membrane are obtained first, where solvation effects are simulated…

We simulate the liquid silicon surface with first-principles molecular dynamics in a slab geometry. We find that the atom-density profile presents a pronounced layering, similar to those observed in low-temperature liquid metals like Ga and…

This paper has been withdrawn by the authors because the paper is largely revised and improved, and to appear in Mechanics Research Communications.

This paper has been withdrawn for the reasons mentioned in the Comments.

Manuscript withdrawn by the authors.

Large-scale first principles molecular dynamics are crucial for simulating complex processes in chemical, biomedical, and materials sciences. However, the unfavorable time complexity with respect to system sizes leads to prohibitive…

We report an ab-initio simulation of liquid Indium in a wide range of pressures and temperatures. We calculate equation of state, thermal expansion and compressibility coefficients. The structure of the system is analyzed by radial…

This paper has been withdrawn by the authors as requested by the journal.

This paper has been withdrawn by the author(s), due a crucial error in the data.

This paper has been withdrawn by the author due to a crucial error in the definition of homomorphism.

This paper has been withdrawn by the first author due to disagreement with experiments.

This paper has been withdrawn by the author due to a crucial mistakes.

This paper has been withdrawn by the author due to errors and bad formalization.

This paper has been withdrawn.