Density calculations and manipulations
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| Subroutine | Description | The routine at work ... | Author, Creation date |
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| densalyt | contructs the analytic density of Hooke's atom for k=1/4 on the y grid with parameter r0 | missing! | Heiko Appel, 11.22.99 |
| denscal | takes the present density and an orginial one, scaled onto the present grid, and calculates the correlation energy difference between them | missing! | Kieron, 10.4.99 |
| densder | fills the density derivatives in, using logarithmic derivatives | missing! | Kieron Burke, 8.14.99 |
| densfill | fills the density in, which one determined by several parameters. | missing! | Kieron Burke, 8.14.99 |
| density | constructs the reduced density for a given solution to Hooke's atom. | missing! | Heiko Appel, 5.18.99 |
| densout | writes out the density and its derivatives into unit 31 | missing! | Kieron Burke, 8.14.99 |
| dlhooke | constructs the log of the reduced density for a given solution to Hooke's atom. | missing! | Kieron Burke, 8.14.99 |
| dlkais | produces the log of the Hooke's atom density for k=1/4 | missing! | Kieron Burke, 8.14.99 |
| dlone | produces the log of an analytic 1-e density. | missing! | Kieron Burke, 8.14.99 |
| expdens | produces a 3D exponential density, normalized to 1 | missing! | Kieron Burke, 5.12.99 |
Last Modified: January 14, 2000
Heiko Appel, email:
appel@physics.rutgers.edu