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1. Full Text Journal of chemical theory and computation
American Chemical Society
2005
Molecular dynamics | Mécanique statistique | Chimie quantique | Quantum chemistry | Statistical mechanics
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2. Free energy computations
: a mathematical perspective
by Lelièvre, Tony and Rousset, Mathias, 1980 and Stoltz, Gabriel
2010, ISBN 1848162472, xii, 458
Statistical physics | Mathematical models | Gibbs' free energy
Book
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3. Full Text Transfer Matrix Computation for Intake Elements with Large Pressure Fluctuations under Mean Flow Conditions
by Mezher, Haitham, author and Migaud, Jérôme, author and Chalet, David, author and Raimbault, Vincent, author and Chesse, Pascal, author and Huurdeman, Bernhard, author
SAE technical paper series, Volume 2012-01-0672.
Thermodynamics | Simulation and modeling | Engines
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4. COMPEL
COMPEL, ISSN 0332-1649, 1982
Electrical engineering | Electronics | Periodicals | Mathematics
Journal
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5. A short introduction to quantum information and quantum computation
by Le Bellac, Michel
2006, ISBN 9780521860567, Volume 9780521860567, x, 167
Quantum computers | Quantum theory
Book
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6. Indirect calorimetry
: techniques, computations and applications
by Gerrits, W. J .J., editor and Labussière, E. editor
2015, ISBN 9086862616, 293 pages
Methodology | Indirect calorimetry | Animal heat
Book
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7. Full Text The stochastic thermodynamics of computation
by Wolpert, David H
Journal of physics. A, Mathematical and theoretical, ISSN 1751-8113, 4/2019, Volume 52, Issue 19, p. 193001
stochastic thermodynamics | finite automata | thermodynamics of computation | nonequilibrium statistical physics | information ratchets | computer science theory | turing machines | Physics, Multidisciplinary | Physical Sciences | Physics | Physics, Mathematical | Science & Technology
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8. Full Text Advances, Updates, and Analytics for the Computation-Ready, Experimental Metal–Organic Framework Database: CoRE MOF 2019
by Chung, Yongchul G and Haldoupis, Emmanuel and Bucior, Benjamin J and Haranczyk, Maciej and Lee, Seulchan and Zhang, Hongda and Vogiatzis, Konstantinos D and Milisavljevic, Marija and Ling, Sanliang and Camp, Jeffrey S and Slater, Ben and Siepmann, J. Ilja and Sholl, David S and Snurr, Randall Q
Journal of chemical and engineering data, ISSN 0021-9568, 12/2019, Volume 64, Issue 12, pp. 5985 - 5998
Thermodynamics | Engineering | Physical Sciences | Engineering, Chemical | Chemistry | Technology | Chemistry, Multidisciplinary | Science & Technology
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9. Full Text Energy Limits in Computation
: A Review of Landauer's Principle, Theory and Experiments
by Lent, Craig S and Orlov, Alexei O and Porod, Wolfgang and Snider, Gregory L
2018, ISBN 3319934570, 245
Thermodynamics
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10. Full Text An Exponential Integrator with Schur–Krylov Approximation to accelerate combustion chemistry computation
by Liu, Zaigang and Consalvi, Jean-L and Kong, Wenjun
Combustion and flame, ISSN 0010-2180, 05/2019, Volume 203, pp. 180 - 189
Exponential integrator | Krylov subspace | Mechanism reduction | Chemistry computation acceleration | Thermodynamics | Engineering | Physical Sciences | Engineering, Chemical | Technology | Engineering, Multidisciplinary | Energy & Fuels | Engineering, Mechanical | Science & Technology | Methane | Combustion | Models | Algorithms | Analysis | Chemical reduction | Organic chemistry | Combustion chemistry | Accuracy | Approximation | Computer simulation | Mathematical analysis | Acceleration | Rounding | Computing time
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11. Entangled world
: the fascination of quantum information and computation
by Audretsch, Jürgen, 1942
2006, ISBN 9783527404704, xii, 300
Quantum theory | Quantum computers
Book
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12. Full Text Impact of P and Sr on solidification sequence and morphology of hypoeutectic Al–Si alloys: Combined thermodynamic computation and phase-field simulation
by Eiken, Janin and Apel, Markus and Liang, Song-Mao and Schmid-Fetzer, Rainer
Acta materialia, ISSN 1359-6454, 10/2015, Volume 98, pp. 152 - 163
Phase-field | Microstructure simulation | Al–Si | Calphad | Eutectic | Al-Si | Materials Science | Technology | Materials Science, Multidisciplinary | Metallurgy & Metallurgical Engineering | Science & Technology | Aluminum compounds | Thermodynamics | Precipitation (Meteorology) | Alloys | Silicon | Anisotropy | Strontium | Nucleation | Intermetallic compounds | Aluminum | Eutectic temperature | Morphology | Formations
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13. Full Text Isogeometric fluid-structure interaction: theory, algorithms, and computations
by Bazilevs, Y and Calo, V M and Hughes, T J. R and Zhang, Y
Computational mechanics, ISSN 0178-7675, 12/2008, Volume 43, Issue 1, pp. 3 - 37
Isogeometric analysis | Space-time Piola transformation | Moving domains | Shape derivatives | Computational Science and Engineering | Theoretical and Applied Mechanics | Fluid-structure interaction | Blood flow | NURBS | Engineering | Mechanics, Fluids, Thermodynamics | Mesh movement | Hyperelastic solids | Cardiovascular modeling | Incompressible fluids | Incompressible flow | Algorithms | Conservation equations | Computational fluid dynamics | Discretization | Fluid flow | Derivation | Time integration
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14. Full Text Real-Time Computing Without Stable States: A New Framework for Neural Computation Based on Perturbations
by Maass, Wolfgang and Natschläger, Thomas and Markram, Henry
Neural computation, ISSN 1530-888X, 11/2002, Volume 14, Issue 11, pp. 2531 - 2560
Article | Neurosciences | Life Sciences & Biomedicine | Technology | Computer Science | Computer Science, Artificial Intelligence | Neurosciences & Neurology | Science & Technology | Learning and adaptive systems | General aspects | Exact sciences and technology | Biological and medical sciences | Physics | Classical ensemble theory | Computer science; control theory; systems | Fundamental and applied biological sciences. Psychology | Mathematics in biology. Statistical analysis. Models. Metrology. Data processing in biology (general aspects) | General | Applied sciences | Classical statistical mechanics | Statistical physics, thermodynamics, and nonlinear dynamical systems | Artificial intelligence | Action Potentials - physiology | Computers | Computer Simulation | Neurons - physiology | Computer Systems | Models, Neurological | Neural Networks (Computer) | Index Medicus
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15. Full Text Computation of pH‐dependent binding free energies
by Kim, M. Olivia and McCammon, J. Andrew and Glick, Gary
Biopolymers, ISSN 0006-3525, 01/2016, Volume 105, Issue 1, pp. 43 - 49
pH dependence | protonation | protein–ligand binding | binding free energy | pKa | protein-ligand binding | Biochemistry & Molecular Biology | Biophysics | Life Sciences & Biomedicine | Science & Technology | Thermodynamics | Proteins - chemistry | Models, Chemical | Computer Simulation | Hydrogen-Ion Concentration | Chemical properties | Hydrogen-ion concentration | Biopolymers | Protein binding | Index Medicus | Binding | Origins | Computation | Binding energy | Protonation | Docking | Free energy
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