The calculation was done using a code called VASP (Vienna Ab-initio Simulation Package).

The NEB method has been incorperated into the DFT code VASP (Vienna Ab-initio Simulation Package).

ab-initio calculation of diffusion mechanisms in semiconductors;

Validating a strategy for designing ab-initio-type EDF functionals, based on completely microscopic ingredients and benchmarked on ab-initio EFT-based results.

Next, the physicochemical property is calculated by molecular modeling using semi-empirical or ab-initio calculations.

The Horizon CPL (H) course is available for ab-initio trainee pilots.

Simulators in 3 Locations covering Ab-Initio, Corporate and Airline Pilot Training

In particular, there was no recruitment for MCTS ab-initio officers in 2012-13.

Quantum chemical methods such as ab-initio calculations are applied in order to produce approximate wave functions for the molecules.

However, many of these factors are subsumed within the initial lodestar calculation.

Most of her recent work are based on ab-initio calculations.

Ab-initio simulation of the bismuth-dielectric nanowire interface and study of various elements of chemical passivation. ?

These effects were investigated using ab-initio molecular dynamics simulations.

Ab-initio simulation of the bismuth-dielectric nanowire interface and study of various elements of chemical passivation. ?

Ab-initio candidates may receive other flight training awards and scholarships.