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Density functional theory
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61	PDF Document Add to Reading List Source URL: www.physast.uga.edu Language: English - Date: 2004-02-13 11:08:55 Differential calculus Functional derivative Physical quantities Density functional theory Defining equation Mathematical descriptions of physical laws Physics Electromagnetism Computer programming
62	New bounds for atomic clusters∗ Tam´ as Vink´ o Research Group on Artificial Intelligence of the Hungarian Academy of Sciences and University of Szeged, Add to Reading List Source URL: www.mat.univie.ac.at Language: English - Date: 2005-06-23 06:38:21 Science Thermodynamics Morse potential Quantum chemistry Lennard-Jones potential Potential energy Density functional theory Particle in a spherically symmetric potential Chemistry Physics Chemical bonding
63	Zero-temperature equation of state of solid 4He at low and high pressures Add to Reading List Source URL: www.claudiocazorla.com Language: English - Date: 2010-02-11 04:56:58 Crystal Diffusion Monte Carlo Potential energy Electron Ice Physics Computational chemistry Density functional theory
64	week ending 15 FEBRUARY 2013 PHYSICAL REVIEW LETTERS PRL 110, ) Add to Reading List Source URL: publik.tuwien.ac.at Language: English - Date: 2013-03-05 02:47:32 Technology Heterojunction Photovoltaics Crystal Thin film solar cell Shockley–Queisser limit Density functional theory Solar cells Energy Energy conversion Semiconductor devices
65	1064 Goldschmidt Conference Abstracts Formation of a layered FeIII (hydr)oxide intercalated with Add to Reading List Source URL: goldschmidt.info Language: English - Date: 2011-09-22 13:35:03 Molecular modelling Actinide Periodic table Ab initio quantum chemistry methods Hydroxide Density functional theory Molecular dynamics Oxide Chemistry Computational chemistry Theoretical chemistry
66	Screened Coulomb Hybrid Density Functionals Add to Reading List Source URL: scuseria.rice.edu Language: English - Date: 2004-04-25 20:26:47 Quantum chemistry Atomic physics Density functional theory Hybrid functional Computational chemistry Electronic band structure Hartree–Fock method Ionization energy Chemistry Physics Theoretical chemistry
67	ARTICLE pubs.acs.org/JPCA TD-CI Simulation of the Electronic Optical Response of Molecules in Intense Fields II: Comparison of DFT Functionals and EOM-CCSD Jason A. Sonk and H. Bernhard Schlegel* Add to Reading List Source URL: chem.wayne.edu Language: English - Date: 2012-01-05 13:44:13 Hybrid functional Time-dependent density functional theory Crystal Chemistry Density functional theory Physics
68	Dear Soft Matter Colleagues, Add to Reading List Source URL: www.softmatterworld.org Language: English - Date: 2015-01-07 17:34:24 Non-Newtonian fluids Complex fluids Condensed matter physics Nanopore Density functional theory Matter Physics Soft matter
69	ORNL/UTK team maps the nuclear landscape The nuclear density functional theory, coupled with state-of-the-art computational tools, was used to estimate the borders of the nuclear landscape and elucidate its properties. Add to Reading List Source URL: www.phy.ornl.gov Language: English - Date: 2012-12-17 16:10:12 Quantum mechanics Nucleosynthesis Nuclear drip line Table of nuclides Drip line Neutron number Radioactive decay P-nuclei Physics Nuclear physics Particle physics
70	Microsoft Word - bericht 2007_teil1.doc Add to Reading List Source URL: www.kofo.mpg.de Language: English - Date: 2014-11-10 05:44:33 Ab initio quantum chemistry methods Molecular modelling Semi-empirical quantum chemistry method Coupled cluster MNDO Ab initio Hypervalent molecule Molecular dynamics Density functional theory Chemistry Computational chemistry Theoretical chemistry

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