- Committer: Nick Papior
- Date: 2017-06-25 19:24:31 UTC
- Revision ID: nickpapior@gmail.com-20170625192431-w3f89vsl66q8o397
Updated several smaller parts to use the Kahan summation
These routines now use Kahan summation for their summations:
- dfscf (forces and stress)
- poison (total energy)
- spin-orbit (initial calculation of energy)
- siesta_analysis (charge)
These routines now use Kahan summation for their summations:
- dfscf (forces and stress)
- poison (total energy)
- spin-orbit (initial calculation of energy)
- siesta_analysis (charge)
| Filename | Latest Rev | Last Changed | Committer | Comment | Size | ||
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Docs
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1 | 19 years ago | Alberto Garcia | initial import (automatically generated log messa |
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Examples
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1 | 19 years ago | Alberto Garcia | initial import (automatically generated log messa |
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Obj
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361.1.4 | 13 years ago | Jose M Soler | Restored Obj directory |
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Pseudo
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1 | 19 years ago | Alberto Garcia | initial import (automatically generated log messa |
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Src
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1 | 19 years ago | Alberto Garcia | initial import (automatically generated log messa |
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Tests
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124 | 18 years ago | Alberto Garcia | Re-organization of Tutorials and Tests Updated |
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Tutorials
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16 | 19 years ago | Alberto Garcia | Siesta-1.2.15 (changes for School, non-coll gga, s |
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Util
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1 | 19 years ago | Alberto Garcia | initial import (automatically generated log messa |
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.bzrignore |
391.1.769 | 7 years ago | Nick Papior | Merged in trunk 508 (SOC) | 11 bytes |
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AUTHORS |
483.2.1 | 8 years ago | Alberto Garcia | Prepare GPL release * Include proper headers * A | 80 bytes |
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COPYING |
483.2.1 | 8 years ago | Alberto Garcia | Prepare GPL release * Include proper headers * A | 34.2 KB |
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NOTICE.txt |
560.5.1 | 7 years ago | Nick Papior | Bug fixed for long buffer writes in wxml - Someti | 1.5 KB |
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README |
483.3.14 | 7 years ago | Alberto Garcia | Release of siesta-4.0 * Update Docs/release_notes | 583 bytes |
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README_TRANSIESTA |
295.1.2 | 14 years ago | Alberto Garcia | TS manual and updates. Building rationalization. H | 95 bytes |
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RELEASE_NOTES |
570 | 7 years ago | Nick Papior | Merged 4.1, r586 This merge contains several impr | 413 bytes |
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version.info |
625 | 6 years ago | Nick Papior | Updated several smaller parts to use the Kahan sum | 23 bytes |
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