Density functional theory - PDFSEARCH.IO - Document Search Engine

Density functional theory
Results: 328

#	Item
171	PhiSX: The electronic structure of matter Add to Reading List Source URL: orion.pt.tu-clausthal.de Language: English - Date: 2013-10-06 18:37:21 Quantum mechanics Computational chemistry Theoretical chemistry Atomic physics Hartree–Fock method Density functional theory Slater determinant Schrödinger equation Propagator Physics Chemistry Quantum chemistry
172	More quantum chemistry with BOINC Martin Korth Theory of Condensed Matter group, Cavendish Laboratory University of Cambridge The 6th BOINC Workshop — [removed] Add to Reading List Source URL: boinc.berkeley.edu Language: English - Date: 2010-09-02 04:26:29 Theoretical chemistry QM/MM Hartree–Fock method Ab initio quantum chemistry methods Density functional theory Quantum chemistry ONIOM Chemistry Computational chemistry Science
173	APS March Meeting 2015 San Antonio, Texas http://www.aps.org/meetings/march/index.cfm Thursday, March 5, 2015 8:00AM - 10:12AM Add to Reading List Source URL: flux.aps.org Language: English - Date: 2015-03-18 11:15:01 Quantum mechanics Computational chemistry Molecular modelling Force fields Molecular dynamics Local-density approximation Orbital-free density functional theory Crystal Water vapor Physics Chemistry Density functional theory
174	Microsoft Word[removed]doc Add to Reading List Source URL: goldschmidt.info Language: English - Date: 2009-09-25 11:26:23 Molecular dynamics Adsorption Density functional theory Properties of water Crystal Chemistry Catalysis H2O
175	PDF Document Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2011-09-01 06:04:46 Computational physics Quantum chemistry Theoretical chemistry Density functional theory Time-dependent density functional theory Hartree–Fock method Matrix Chemistry Physics Computational chemistry
176	Max Planck Institute of Microstructure Physics Theory Department Basic rules for functional construction at finite temperature C. Bersier, C. Proetto, A. Sanna, A. Cangi, S.H. Mirhosseini Add to Reading List Source URL: www2.mpi-halle.mpg.de Language: English - Date: 2011-11-07 04:21:13
177	FunctionalsNonCollMagnetism.dvi Add to Reading List Source URL: www2.mpi-halle.mpg.de Language: English - Date: 2013-06-11 06:55:02 Magnetism Physical quantities Introductory physics Density functional theory Magnetic field Magnetization Magnet Physics Electromagnetism Magnetostatics
178	Max Planck Institute of Microstructure Physics Theory Department Electronic structure via potential functional approximations A. Cangi, C. Proetto Add to Reading List Source URL: www2.mpi-halle.mpg.de Language: English - Date: 2011-11-07 04:20:33 Kinetic energy Time-dependent density functional theory Local-density approximation Physics Chemistry Density functional theory
179	Additional background material on the Nobel Prize in Chemistry 1998 The Royal Swedish Academy of Sciences has decided to award the 1998 Nobel Prize in Chemistry with one half to Professor WALTER KOHN, University of Calif Add to Reading List Source URL: www.nobelprize.org Language: English - Date: 2012-05-11 07:22:51 Quantum chemistry Hartree–Fock method Crystal Density functional theory Ab initio quantum chemistry methods John Pople Semi-empirical quantum chemistry method Gaussian Walter Kohn Chemistry Theoretical chemistry Computational chemistry
180	PHYSICAL REVIEW A 74, 012508 共2006兲 Implicit density-functional theory Bin Liu Physics Department, New York University, 4 Washington Place, New York, New York 10003, USA Add to Reading List Source URL: www.binliulab.com Language: English - Date: 2014-09-03 11:16:07 Kinetic energy Density functional theory Physics Calculus of variations Quantum harmonic oscillator

UPDATE