feff.phys.washington.edu

The FEFF Project

Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. Click to get Flash Player. Or try to enable JavaScript and reload the page. Execute High-Performance calculations without buying computer hardware or installing parallel software. The SC2IT interface deploys your calculations on preconfigured compute clusters in the Amazon EC2 Cloud. BSE Approach for Spectroscopy. Check out our latest research reports and find reference materials on our methods. The FEFF group will pre...

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The FEFF Project | feff.phys.washington.edu Reviews

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Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. Click to get Flash Player. Or try to enable JavaScript and reload the page. Execute High-Performance calculations without buying computer hardware or installing parallel software. The SC2IT interface deploys your calculations on preconfigured compute clusters in the Amazon EC2 Cloud. BSE Approach for Spectroscopy. Check out our latest research reports and find reference materials on our methods. The FEFF group will pre...

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4 scientific cloud computing

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10 dmdw

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The FEFF Project | feff.phys.washington.edu Reviews

https://feff.phys.washington.edu

Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. Click to get Flash Player. Or try to enable JavaScript and reload the page. Execute High-Performance calculations without buying computer hardware or installing parallel software. The SC2IT interface deploys your calculations on preconfigured compute clusters in the Amazon EC2 Cloud. BSE Approach for Spectroscopy. Check out our latest research reports and find reference materials on our methods. The FEFF group will pre...

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feff.phys.washington.edu

1

The FEFF Project - About our Scientific Software

http://feff.phys.washington.edu/feffproject-software.html

Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. About our SCIENTIFIC SOFTWARE developments. Thrust A: FEFFMPI, DFTMD2FEFF and auxiliary codes. Thrust B: AI2NBSE and OCEAN. Thrust C: RT-SIESTA and RTXS. Molecular dynamics and Monte Carlo simulations of supported metallic clusters using model potential. This code implements the velocity-Verlet algorithm together with a variety of thermostats, as well as a Metropolis Monte Carlo approach. Excited state calculations of ...

2

The FEFF Project

http://feff.phys.washington.edu/index-feffproject.html

Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. Click to get Flash Player. Or try to enable JavaScript and reload the page. Execute High-Performance calculations without buying computer hardware or installing parallel software. The SC2IT interface deploys your calculations on preconfigured compute clusters in the Amazon EC2 Cloud. BSE Approach for Spectroscopy. Check out our latest research reports and find reference materials on our methods. The FEFF group will pre...

3

The FEFF Project - DMDW

http://feff.phys.washington.edu/feffproject-dmdw.html

Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. DMDW: A set of tools to calculate Debye-Waller factors and other vibrational properties using dynamical matrices. There are typically many more independent DW factors in the XAFS MS path expansion than can be fit reliably to the available data. They require separate fits to appropriate Debye or Einstein temperatures for each multiple-scattering path. A detailed description of the methodology can be found in:. F D Vila,...

4

The FEFF Project - AI2NBSE

http://feff.phys.washington.edu/feffproject-ai2nbse.html

Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. Is a versatile and user-friendly package for calculating dielectric response including excitonic effects. This is a first-principles code based on both ground-state density-functional theory and the Bethe-Salpeter equation. AI2NBSE utilizes the program ABINIT. The code is currently in pre-release. A beta version is currently available on the download. Builds feff.inp input files for the FEFF9 code based on crystall...

5

The FEFF Project - References

http://feff.phys.washington.edu/feffproject-references.html

Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. Dynamical Structural Disorder in Supported Nanoscale Catalysts. SIXNS-I Report Now Out. DNA Bases on Graphene. We describe the development of a scientific cloud computing (SCC) platform that offers high performance computation capability. The platform consists of a scientific virtual machine prototype containing a UNIX operating system and several materials science codes, together with essential interface tools (an...

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feff.phys.washington.edu

The FEFF Project

Scientific Software Innovation Institute SIXNS. Tables of ab initio optical constants. Click to get Flash Player. Or try to enable JavaScript and reload the page. Execute High-Performance calculations without buying computer hardware or installing parallel software. The SC2IT interface deploys your calculations on preconfigured compute clusters in the Amazon EC2 Cloud. BSE Approach for Spectroscopy. Check out our latest research reports and find reference materials on our methods. The FEFF group will pre...

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