SCALE 5.1 ORIGEN-S Libraries Update December 12, 2007 Description ------------ This update contains changes in the ORIGEN card-image cross-section library to correct cross section values obtained from the FENDL-2.0 evaluated nuclear data library. Only FENDL data were updated. The updated library origen.rev03.pwrlib.data replaces the previous version origen.rev02.pwrlib.data. As a result of these changes to the card-image library, the binary library PWR33GWD was updated to origen.rev04.pwr33gwd. This update supercedes the previous update to origen.rev03.pwr33gwd posted on August 7, 2007. The impact of this update is that results for some activation product (i.e. light element) nuclides are corrected. Actinide and fission product inventories are largely unchanged. Large differences were reported in comparisons of the calculated isotopic activities obtained using the card-image library (with typical values of the flux weighted factors) and activities calculated using the one of the new ORIGEN-ARP binary cross section library. Evaluation of the discrepancies revealed that differences were caused by incorrect FENDL-2.0 based cross sections. A systematic error occurred during processing of the FENDL data due to a non-standard format used to represent reaction transitions to metastable product states. The FENDL library contains partial cross sections for each reaction channel to different product states. For example, capture reactions to the ground state are stored as MT=102, to the first metastable state as MT=402, and second metastable state as MT=702. Only the MT=102 transitions to ground state levels were recognized and included in the total capture cross section during processing. Therefore, cross sections for isotopes with a significant branching fraction leading to metastable states were systematically underestimated. The FENDL data discrepancies in the card-image library do not apply to the binary libraries for most isotopes because problem-dependent data from ENDF/B-V evaluations are used to update the card-image data. However, some FENDL data are retained when ENDF/B-V cross sections are not available. It was also observed that several high energy threshold reaction cross sections changed for transitions that do not have metastable product states. Further analysis found the cause to be associated with temperature broadening of the pointwise FENDL data by an AMPX routine that incorrectly shifted the cross section data by one energy grid point. For threshold reactions with relative coarse energy grid points and peak reaction rates occurring near the threshold energy, this shift caused significant changes in the group cross section values. The updated data were generated without temperature broadening. Changes were made to the library data processing routines to include all branching transitions in calculating the cross sections required by ORIGEN and the library was regenerated. The number of cross section changes is extensive. A summary of all cross section values that changed by more than 1% is listed in a separate file: www.ornl.gov/sci/scale/downloads/origen-libraries-update-details.txt. These changes will result in minor changes in some of the SCALE sample problems that depend on ORIGEN-S or ORIGEN-S data (e.g., ORIGEN-S, OPUS, TRITON, SAS1, SAS2) Installation instructions ------------------------- Windows: -------- Windows users can download and install the self-extracting WinZip file origen-libraries-update.exe file. This update installs the following files: \scale5.1\data\origen_data\origen.rev03.pwrlib.data \scale5.1\data\origen.rev04.pwr33gwd \scale5.1\cmds\scale5.bat \scale5.1\test\drr08003origen.input \scale5.1\output\drr08003origen.out Run the test case named drr08003origen.input that is installed to \scale5.1\test. You can use the command line "batch5 -m drr08003origen.input" or you can drag-and-drop the input file on the "Run SCALE5.1" icon. Compare the output file drr08003origen.out to the ORNL version in \scale5.1\output. Unix/Linux: ----------- Download origen-libraries-update.tar.gz. Unzip and untar in the directory above the head scale5.1 directory. This update installs the following files: /scale5.1/data/origen_data/origen.rev03.pwrlib.data /scale5.1/data/origen.rev04.pwr33gwd /scale5.1/test/d08003_origen.input /scale5.1/output/d08003_origen.linux.output /scale5.1/output/d08003_origen.unix.output Run the test case d08003_origen.input and compare the output file with the ORNL output file for your operating system (unix or linux).