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Mathematical chemistry
Results: 466

#	Item
41	First-Passage Monte Carlo: Hydrogen transport in damaged tungsten U. von Toussaint, T. Schwarz-Selinger Max-Planck-Institut für Plasmaphysik, Garching, Germany Add to Reading List Source URL: psi2014.nifs.ac.jp Language: English - Date: 2014-07-07 20:13:51 Partial differential equations Chemistry Quantum mechanics Diffusion equation Reaction–diffusion system Molecular diffusion Random walk Tritium Physics Diffusion Mathematical analysis
42	Our partners Improving prediction robustness from hard and soft modeling Jplus Consulting was formed in 2009 to develop and commercialise innovative multivariate Industry: Add to Reading List Source URL: www.camo.com Language: English - Date: 2011-04-11 01:25:04 Computational chemistry Spectroscopy Analytical chemistry The Unscrambler Multivariate statistics Multivariate analysis Data analysis Chemical equilibrium Mathematical model Chemistry Science Statistics
43	The Impact of Mathematical Modeling on the Production of Special Purpose Cement Domenico Lahaye and his helping friends November 13, 2013 Introduction Add to Reading List Source URL: ta.twi.tudelft.nl Language: English - Date: 2013-12-24 07:59:39 Lime kilns Technology Industrial furnaces Concrete Engineering Cement kiln Rotary kiln Combustion NOx Kilns Chemistry Chemical engineering
44	Conformational Splitting: A More Powerful Criterion for Dead-End Elimination N. A. PIERCE,1,∗ J. A. SPRIET,2 J. DESMET,2,† S. L. MAYO3 1 Division of Biology, California Institute of Technology, Pasadena, California Add to Reading List Source URL: www.piercelab.caltech.edu Language: English - Date: 2010-09-08 02:56:25 Dead-end elimination Mathematical optimization Bioinformatics Stereochemistry Conformational isomerism Protein design STING Homology modeling Computational chemistry Chemistry Protein methods Protein structure
45	THE JOURNAL OF CHEMICAL PHYSICS 133, Ground and excited electronic states of azobenzene: A quantum Monte Carlo study M. Dubecký,1 R. Derian,1 L. Mitas,2 and I. Štich1,a) 1 Add to Reading List Source URL: altair.physics.ncsu.edu Language: English - Date: 2011-10-09 23:09:35 Science Mathematical optimization Quantum Monte Carlo Variational Monte Carlo Density functional theory ACES Computational chemistry Chemistry Quantum chemistry Theoretical chemistry
46	Commun. Math. Phys. 161, Communications in Mathematical Physics Add to Reading List Source URL: www.researchgate.net Language: English Hamiltonian mechanics Calculus of variations Lattice Wave equation Hamiltonian Boussinesq approximation Contributors to general relativity Reciprocal lattice Physics Chemistry Mathematical analysis
47	THE R-FUNCTIONS METHOD IN MATHEMATICAL MODELING OF CONVECTIVE HEAT TRANSFER IN FUEL CARTRIDGE WITH FUEL RODS K.V. Maksimenko-Sheyko∗, R.A. Uvarov, T.I. Sheyko Podgorny Institute for Mechanical Engineering Problems of N Add to Reading List Source URL: vant.kipt.kharkov.ua Language: English - Date: 2013-06-19 10:35:58 Heat transfer Mechanical engineering Chemical engineering Heat equation Nuclear fuel Differential equation Viscosity Thermal conductivity Chemistry Physics Heat conduction
48	Pseudopotentials (Part I): Georg KRESSE ¨ Materialphysik and Center for Computational Materials Science Institut fur Universit¨at Wien, Sensengasse 8, A-1090 Wien, Austria Add to Reading List Source URL: cms.mpi.univie.ac.at Language: English - Date: 2003-02-06 08:11:56 Chemistry Quantum mechanics Electronic band structure Free electron model Bloch wave Hamiltonian Periodic function Physics Condensed matter physics Mathematical analysis
49	Reducing volatility and financial risk and increasing returns by producing coproducts in a lignocellulosic bio-refinery Fuel prices have shown high volatility over the last 10 years Ø High volatility = high risk Ø Rep Add to Reading List Source URL: www.bioenergyaustralia.org Language: English - Date: 2015-06-01 20:39:25 Biofuels Liquid fuels Financial economics Ethanol fuel Volatility Ethanol Variance Futures contract Chemistry Mathematical finance Statistics
50	Professor Nikolay S. Zefirov Full member of Russ. Acad. Sci. Distinguished Professor of MSU. Full member of International Academy of Mathematical Chemistry. Add to Reading List Source URL: www.chem.msu.ru Language: English - Date: 2001-12-31 16:23:50