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MIT Atomic-Scale Modeling Toolkit
Tools for Atomic-Scale Modeling
Version 5.10 - published on 11 Dec 2023
doi:10.21981/P4KR-ZH89 cite this
This tool is closed source.
Supporting Docs
- Computer Modeling Module: Chemical Reaction Simulation using SIESTA
- Introduction to Computational Modeling - Input Parameters for SIESTA Simulation
- Introduction to Computational Modeling - Schrödinger Equation, Density Functional Theory (DFT), Kohn-Sham Method, DFT Code SIESTA
- Overview of Computational Nanoscience: a UC Berkeley Course
- Simulating Electronic Properties of Materials Using Ab Initio Modeling with SIESTA on nanoHUB.org
- 2022-10-12_nanoHUB_webinar_exercises.pdf
- 2022-10-12_nanoHUB_webinar_slides.pdf
- QESPRESSO_with_MIT_AST_Intro_26_OCT_2022.pdf
- Quantum_ESPRESSO_guide_26_OCT_2022_v1.1.docx
- Quantum_ESPRESSO_guide_26_OCT_2022_v1.1.pdf
- A Guide to the MIT Atomic Scale Modeling Toolkit for nanoHUB.org
- A Condensed Matter Physics class and a Course-Based Undergraduate Research Experience (CURE) with the MIT Atomic-Scale Modeling Toolkit
- Interactive Modeling of Materials with Density Functional Theory Using the Quantum ESPRESSO Interface within the MIT Atomic Scale Modeling Toolkit
- MIT_ASMT_guide_7_DEC_2022_v1.0.pdf
- MIT_ASMT_guide_7_DEC_2022_v1.0.docx