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Atomic Reference Data
for Electronic Structure Calculations
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Version History
- Example of how to reference this online database: (Replace year, month day with database access date.)
- Kotochigova, S., Levine, Z.H., Shirley, E.L., Stiles, M.D., and Clark, C.W. (2003), Atomic Reference Data for Electronic Structure Calculations (version 1.3). [Online] Available: http://physics.nist.gov/DFTdata [year, month day]. National Institute of Standards and Technology, Gaithersburg, MD.
Optional addition: Kotochigova, S., Levine, Z.H., Shirley, E.L., Stiles, M.D., and Clark, C.W. Local-density functional calculations of the energy of atoms, Phys. Rev. A 55, 191 (1997); erratum 56, 5191 (1997).
- Citation Form:
- Author/editor (Year), Title (edition). [Type of medium] Available: URL [Access date].
Version 1.6
March 2009 |
A correction was made to equation 35. |
Version 1.5
January 2009 |
A section was added to Chapter 2 to address the value of the inverse fine-structure constant. |
Version 1.4
March 2005 |
Table for 62Sm (column 5, samarium) was corrected. All tables are now available in HTML table format and ASCII text format. |
Version 1.3
April 2003 |
Improvements were made to meet accessibility requirements. |
Version 1.2
April 2001 |
The ASCII LaTeX source for each equation image has been made available in order to meet accessibility requirements. |
Version 1.1
April 1999 |
The text has been reformatted with a navigation bar at the bottom of each page. Equations have been converted to a larger font, and a few corrections were made. |
Version 1.0
July 1996 |
This document originally appeared as http://math.nist.gov/DFTdata/. |
Earlier Work |
S. Kotochigova, Z.H. Levine, E.L. Shirley, M.D. Stiles, and C.W. Clark
"Local-density functional calculations of the energy of atoms"
Phys. Rev. A 55, 191 (1997); erratum 56, 5191 (1997). |
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