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- Title
- TURBOMOLE: Program Package for ab initio Electronic Structure Calculations
- Meta Description
- TURBOMOLE is a powerful Quantum Chemistry (QC) program package and one of the fastest and most stable codes available for standard quantum chemical applications (HF, DFT, MP2). Unlike many other programs, the main focus in the development of TURBOMOLE has not been to implement all new methods and functionals, but to provide a fast and stable code which is able to treat molecules of industrial relevance at reasonable time and memory requirements.
- Meta Keywords
- turbomole, quantum chemistry, ab initio, dft, density functional theory, hartree fock, theoretical chemistry, molecules, calculations, spectra, properties, nmr, vibraions, ir, theory, quantum, theoretical, simulations, molecular dynamics, molecular properties
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