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Theoretical chemistry
Results: 969

#	Item
221	QUANTUM MONTE CARLO STUDY OF BOSONIC SOLIDS AT ZERO TEMPERATURE by CLAUDIO CAZORLA SILVA Universitat Polit`ecnica de Catalunya Add to Reading List Source URL: www.claudiocazorla.com Language: English Quantum Monte Carlo Theoretical physics Computational physics Variational Monte Carlo Variational principle Quantum mechanics Monte Carlo method Condensed matter physics Physics Quantum chemistry Science
222	Packing Nonspherical Particles: All Shapes Are Not Created Equal Salvatore Torquato Department of Chemistry, Department of Physics, Princeton Center for Theoretical Science, Add to Reading List Source URL: cherrypit.princeton.edu Language: English - Date: 2005-02-02 16:52:01 Spheres Discrete geometry Crystallography Sphere packing
223	Time-dependent density functional theory calculations to guide the development of modified organic scintillating materials Lindsay Shuller-Nickles Clemson University Shaniqua Young (SCSU), Ayman Seliman (CU), Add to Reading List Source URL: www.rrmc.info Language: English - Date: 2014-12-28 19:28:09 Density functional theory Quantum mechanics Computational chemistry Quantum chemistry Theoretical chemistry Time-dependent density functional theory Schrödinger equation Excited state Physics Chemistry Science
224	Journal of Biotechnology–23 Theoretical analysis of dynamic force spectroscopy experiments on ligand–receptor complexes M. Raible a , M. Evstigneev a , P. Reimann a,∗ , F.W. Bartels b , R. Ros b a Add to Reading List Source URL: roslab.physics.asu.edu Language: English - Date: 2010-01-04 11:29:45 Computational chemistry Classical mechanics Spectroscopy Force spectroscopy Molecular dynamics Fictitious force Force Constraint algorithm Physics Chemistry Science
225	2008.7 Unraveling the mysteries of molecules and extending their possibilities The aim of the Institute for Molecular Science is to investigate fundamental properties of molecules and molecular ［ORGANIZATION］ Add to Reading List Source URL: www.ims.ac.jp Language: English - Date: 2014-06-17 03:32:09 Computational chemistry Quantum chemistry Molecule Nuclear magnetic resonance Nanotechnology Molecular modelling Spectroscopy Molecular dynamics Inorganic chemistry Chemistry Science Theoretical chemistry
226	http://www.ims.ac.jp Unraveling the mysteries of molecules and extending their possibilities The aim of the Institute for Molecular Science is to investigate fundamental properties of molecules and molecular Add to Reading List Source URL: www.ims.ac.jp Language: English - Date: 2014-06-17 03:32:10 Computational chemistry Quantum chemistry Molecule Nuclear magnetic resonance Molecular structure Spectroscopy Nanotechnology Molecular modelling Molecular dynamics Chemistry Science Theoretical chemistry
227	Scaling down DNA circuits with competitive neural networks Anthony J. Genot, Teruo Fujii and Yannick Rondelez rsif.royalsocietypublishing.org Add to Reading List Source URL: www.dna.caltech.edu Language: English - Date: 2014-01-29 15:08:32 DNA Theoretical computer science Genetics Chemistry DNA computing Logic gate DNA nanotechnology Biology Molecular biology
228	f Solid State Physics Peter E. Blöchl Add to Reading List Source URL: orion.pt.tu-clausthal.de Language: English - Date: 2012-05-09 14:28:53 Computational chemistry Theoretical chemistry Atomic physics Chemical bonding Hartree–Fock method Atomic orbital Slater determinant Molecular orbital Spin contamination Chemistry Physics Quantum chemistry
229	Nagoya University Plaform: Nano/Energy Theoretical Chemistry Colloquium July 24, 2013 (Wed), 16:00-17:00 Add to Reading List Source URL: www.rcms.nagoya-u.ac.jp Language: English - Date: 2015-04-17 00:31:51 Nanomaterials Molten salt Nanostructure Theoretical chemistry IL Nature Science Ionic liquid Ions Chemistry
230	Nagoya University Theoretical Chemistry Colloquium February 4, 2014 (Tue), 14:00-15:00 RCMS, 2nd floor, Chemistry Gallery Add to Reading List Source URL: www.rcms.nagoya-u.ac.jp - Date: 2015-04-17 00:31:58

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