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Ab Initio
Results: 339

#	Item
251	567 Index a ab initio guided design of materials Add to Reading List Source URL: www.wiley-vch.de Language: English - Date: 2013-07-18 21:06:23 Materials science Plastics Adhesives Alloys Composite material Microcellular plastic Metal foam Foam Thermosetting polymer Chemistry Manufacturing Plastics industry
252	1107 Stichwortverzeichnis a Ab-initio-Methoden 660 ff. Add to Reading List Source URL: www.wiley-vch.de Language: German - Date: 2013-10-27 22:06:21
253	Curriculum Vitae December[removed]Personal Data Add to Reading List Source URL: www.mcl.at Language: English - Date: 2013-01-27 12:05:24 Computational physics Theoretical chemistry Ab initio Molecular dynamics ACES PSI Crystal EXC code Chemistry Science Computational chemistry
254	Publications - “Dislocation-core symmetry and slip planes in tungsten alloys: Ab initio calculations and microcantilever bending tests” Add to Reading List Source URL: www.mcl.at Language: English - Date: 2012-11-10 07:39:16 Self-organization Supramolecular chemistry Science Nanotechnology Thin films Self-assembled monolayer
255	Research Networking Programme Advanced Concepts in ab-initio Simulations of Materials (Psi-k2) Standing Committee for Physical and Engineering Sciences (PESC) Add to Reading List Source URL: www.esf.org Language: English - Date: 2012-02-08 05:18:35 Science SIESTA Electronic band structure Hybrid functional Ab initio Molecular dynamics CP2K CONQUEST PSI Density functional theory Physics Chemistry
256	CURRICULUM VITAE Vsevolod Razumovskiy Affiliation: Materials Center Leoben Forschung GmbH (http://www.mcl.at) Roseggerstraße[removed]Leoben, Austria. Tel. +[removed]69; Mob. +[removed] Add to Reading List Source URL: www.mcl.at Language: English - Date: 2013-01-27 12:05:56 Alloys Superalloy Ab initio Aluminium alloy Crystal Intermetallics Heat treating Nickel Materials science Chemistry Metallurgy Aerospace materials
257	j483 Index a ab initio methodology 205, 461, 471 activated carbons (AC) Add to Reading List Source URL: www.wiley-vch.de Language: English - Date: 2012-10-29 22:05:13 Catalysis Emerging technologies Magnetism Magnetic nanoparticles Nanoparticle Carbon nanotube Ionic liquid Heterogeneous catalysis Catalyst support Chemistry Nanomaterials Nanotechnology
258	j647 Index a ab-initio calculations 57, 158, 166, 309 ab-initio molecular orbital (MO) 157 Add to Reading List Source URL: media.wiley.com Language: English - Date: 2013-08-21 16:29:10 Nucleotides Molecular biology DNA Reverse-transcriptase inhibitor Reverse transcriptase DNA replication Nucleobase Nucleotide salvage Nucleoside Biology Genetics RNA
259	Curriculum vitae Mag. Dr. Jürgen Spitaler Ausbildung und Berufserfahrung seit[removed] Add to Reading List Source URL: www.mcl.at Language: English - Date: 2013-01-27 12:06:38 Raman scattering Ab initio Phonon Vanadium Chemistry Fiber-optic communications Theoretical chemistry
260	1 H chemical shifts in NMR: Part 201 Anisotropic and steric effects in halogen substituent chemical shifts (SCS), a modelling and ab-initio investigation Add to Reading List Source URL: www.modgraph.co.uk Language: English - Date: 2012-01-10 04:04:38 Spectroscopy Physical organic chemistry Proton NMR Chemical shift Nuclear magnetic resonance spectroscopy 1H Chemical bond Pyridine Steric effects Chemistry Physics Nuclear magnetic resonance