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6 projects in result set.
ABINIT - ABINIT allows to find from first principles the total energy, charge density, electronic structure and miscellaneous properties of systems made of electrons and nuclei using pseudo-potentials and a plane-wave or wavelet basis.
Tags: PRACE-WP8, MATERIALS
This project has not yet categorized itself in the Trove Software Map


Activity Percentile: 0
Activity Ranking: 0
Registered: 2012-06-19 08:13

Exciting-ELK - Exciting is a full-potential all-electron density-functional-theory (DFT) package based on the linearized augmented plane-wave (LAPW) method. ELK is An all-electron full-potential linearized augmented-plane wave (FP-LAPW) code with many advanced features.
Tags: PRACE-WP8, MATERIALS, density functional theory
This project has not yet categorized itself in the Trove Software Map


Activity Percentile: 0
Activity Ranking: 0
Registered: 2012-06-19 08:19

OCTOPUS - Octopus is a computer code to calculate excitations of electronic systems, i.e., to simulate the dynamics of electrons and nuclei under the influence of external time-dependent fields. The code relies on Density Functional Theory (DFT).
Tags: PRACE-WP8, MATERIALS
This project has not yet categorized itself in the Trove Software Map


Activity Percentile: 0
Activity Ranking: 0
Registered: 2012-06-19 08:17

PRACE-2IP-WP8-QE - Quantum ESPRESSO is an integrated suite of computer codes based on density‐functional theory, plane waves, and pseudo-potentials ‐ separable, norm‐conserving and ultrasoft ‐ and projector‐augmented waves.
Tags: PRACE-WP8, MATERIALS
This project has not yet categorized itself in the Trove Software Map


Activity Percentile: 0
Activity Ranking: 0
Registered: 2012-06-19 08:14

SIESTA - SIESTA is both a method and its implementation as a computer program, to perform electronic structure calculations and ab-initio molecular dynamics simulations of molecules and solids.
Tags: PRACE-WP8, MATERIALS
This project has not yet categorized itself in the Trove Software Map


Activity Percentile: 0
Activity Ranking: 0
Registered: 2012-06-19 08:16

YAMBO - Yambo is an ab initio code for calculating quasiparticle energies and optical properties of electronic systems within the framework of many-body perturbation theory (MBPT) and time-dependent density functional theory (TDDFT).
Tags: PRACE-WP8, MATERIALS
This project has not yet categorized itself in the Trove Software Map


Activity Percentile: 0
Activity Ranking: 0
Registered: 2012-06-19 08:15