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Search Results Adaptive Coordinate Real-space Electronic Structure code (ACRES)
Category: Computers>Programming>Languages>Fortran>Source Code>Physics
Density-functional theory (DFT) code designed to perform total energy calculations for atoms, molecules, bulk solids and surfaces on parallel computers such as CM-5, IBM SP2 and ORIGIN 2000. These calculations are performed in real space on a grid that is adapted to spatially inhomogeneous cutoff (or resolution) requirements of a given system.
http://cst-www.nrl.navy.mil/~singh/acres/info.html
Reviews Rating: Not yet Rated Whois Check
Institute of Physics
Category: Science>Physics>Associations
Devoted to basic research in the fields of physics of atoms, molecules and plasma and solid state physics including surface science. Zagreb, Croatia.
http://www.ifs.hr/en/
Reviews Rating: Not yet Rated Whois Check
On the Constitution of atoms and molecules
Category: Science>Physics>History>People>Bohr, Niels>Publications
Paper published in Philosophical Magazine.
http://dbhs.wvusd.k12.ca.us/Chem-History/Bohr/Bohr-1913a.html
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Relativistic Theory of atoms and molecules
Category: Science>Chemistry>Computational
Searchable database of journal articles focusing largely (but not exclusively) on relativistic ab initio quantum chemical calculations.
http://www.csc.fi/rtam/
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Skytopia - Super Magnet
Category: Science>Math>Recreations
A colourful world built entirely using mathematical atoms and molecules. Pictures and animations demonstrate structures colliding and interacting. Animated GIF demonstrations.
http://www.skytopia.com/project/magnet/magnet.html
Reviews Rating: Not yet Rated Whois Check
Atomix
Category: Games>Video Games>Puzzle>Freeware
Build molecules out of single atoms lying around. (Gnome)
http://www.informatik.uni-oldenburg.de/~pearl/gnome/atomix.html
Reviews Rating: Not yet Rated Whois Check
IBM Almaden STM Molecular Art
Category: Science>Technology>Nanotechnology
Some of the famous images of atoms and molecules made with IBM's scanning tunneling microscope.
http://www.almaden.ibm.com/vis/stm/lobby.html
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Lester, Jr., William A.
Category: Science>Chemistry>Computational>People
Quantum Monte Carlo studies of the electronic structure of atoms and small molecules.
http://www.cchem.berkeley.edu/~walgrp
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Institute of Physics
Category: Regional>Europe>Croatia>Science and Environment
Devoted to basic research in the fields of physics of atoms, molecules and plasma and solid state physics including surface science.
http://www.ifs.hr/en/
Reviews Rating: Not yet Rated Whois Check
Computational Chemistry Comparison and Benchmark Database
Category: Science>Chemistry>Physical>Databases
Database of molecules with well established heat of formation, no atoms with atomic number greater than 17 (Chlorine,) and six or fewer heavy atoms and twenty or fewer total atoms.
http://srdata.nist.gov/cccbdb/Default.htm
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