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AOMix

Size: 63.5 MB
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Name Size
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/run.log 2.5 MB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/fragm1.log 1.7 MB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/fragm2.log 212 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/AOMix-MO-FO-alpha.txt 105 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/AOMix-MPA-fr2.txt 30 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/AOMix-MO-FO-alpha.dat 28 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/AOMix-MPA-fr2-DOS-line.txt 23 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/AOMix-MPA-fr2-DOS.txt 20 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/AOMix-FO.txt 19 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/AOMix-MPA-fr2-OPDOS-line.txt 18 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2004-dirac-BH3CO/AOMix-MPA-fr2-OPDOS.txt 11 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/BH3CO.adfout 380 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/fragm2.log 254 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/fragm1.log 228 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/AOMix-MO-FO-alpha.txt 56 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/AOMix-MPA-fr2-DOS.txt 23 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/AOMix-MO-FO-alpha.dat 20 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/AOMix-MPA-fr2-OPDOS.txt 12 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/AOMix-MPA-fr2.txt 10 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/AOMix-FO.txt 9 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/AOMix-MPA-fr2-DOS-line.txt 6 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/AOMix-MPA-fr2-OPDOS-line.txt 5 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/BH3CO.adfin 1 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/fragm1.adfin 1 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/ADF2005-BH3CO/fragm2.adfin 990 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/CDA-results/AOMix-MPA-fr2-DOS.txt 30 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/CDA-results/AOMix-MPA-fr2-OPDOS.txt 16 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/CDA-results/AOMix-MO-FO-alpha.txt 9 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/CDA-results/AOMix-CDA.txt 5 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/CDA-results/AOMix-MPA-fr2.txt 3 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/CDA-results/AOMix-MO-FO-alpha.dat 2 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/CDA-results/AOMix-MPA-fr2-DOS-line.txt 1 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/CDA-results/AOMix-MPA-fr2-OPDOS-line.txt 1008 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/whole-molecule.out 48 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/fragm1.log 31 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/fragm2.log 29 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/whole-molecule.inp 5 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/AOMix-fragment-wave.dat 4 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/fragm1.inp 525 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions/fragm2.inp 525 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions - UHF/whole-molecule.out 82 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions - UHF/fragm1.log 43 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions - UHF/fragm2.log 42 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions - UHF/whole-molecule.inp 9 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions - UHF/AOMix-fragment-wave.dat 9 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions - UHF/AOMix-CDA.txt 998 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions - UHF/fragm1.inp 521 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/Building-the-initial-guess-from-fragment-wavefunctions - UHF/fragm2.inp 521 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/gamess.log 27 MB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/FRAGM1.LOG 10.7 MB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/FRAGM2.LOG 3.8 MB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-MO-FO-alpha.txt 515 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-MO-FO-alpha.dat 176 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-MPA-fr2.txt 80 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-MPA-fr2-DOS-line.txt 61 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-CDA.txt 46 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-MPA-fr2-OPDOS-line.txt 45 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-MPA-fr2-DOS.txt 18 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-MPA-fr2-OPDOS.txt 9 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gamess(US)/CDA-calculation/AOMix-fr2-chimera.txt 2 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-HCCH/MO-interaction-picture/HCCH.jpg 385 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-HCCH/MO-interaction-picture/HCCH-S4.JNB 234 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-HCCH/C2H2.log 286 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-HCCH/FRAGM2.LOG 113 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-HCCH/FRAGM1.LOG 113 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-HCCH/C2H2.gjf 367 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-HCCH/fragm2.gjf 235 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-HCCH/fragm1.gjf 234 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/NH3BH3-eda.out 252 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/fragm1.log 77 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/fragm2.log 76 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/MO-diagram.JNB 70 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/AOMix-MPA-fr2-DOS.txt 33 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/NH3BH3-eda.gjf 29 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/AOMix-MO-FO-alpha.txt 26 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/AOMix-MPA-fr2-OPDOS.txt 17 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/AOMix-MO-FO-alpha.dat 8 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/AOMix-FO.txt 7 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/AOMix-MPA-fr2.txt 6 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/AOMix-MPA-fr2-DOS-line.txt 3 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/AOMix-MPA-fr2-OPDOS-line.txt 3 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/fragm1.gjf 317 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Gaussian03-NH3BH3/fragm2.gjf 317 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/MO-interaction-picture/MO-diagram.JNB 74 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/AOMix-SCPA-fr2-DOS.txt 28 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/AOMix-MO-FO-alpha.txt 9 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/AOMix-fr2-chimera.txt 9 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/BH3CO.log 7 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/AOMix-FO.txt 6 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/fragm2.log 4 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/fragm1.log 4 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/AOMix-SCPA-fr2.txt 3 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/AOMix-MO-FO-alpha-a1.dat 2 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/AOMix-SCPA-fr2-DOS-line.txt 1 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/HyperChem-BH3CO/AOMix-MO-FO-alpha-e.dat 870 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/whole.log 462 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/fragm2.log 168 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/fragm1.log 88 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/AOMix-MO-FO-alpha.txt 33 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/AOMix-MPA-fr2-DOS.txt 32 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/AOMix-MPA-fr2-OPDOS.txt 17 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/AOMix-MO-FO-alpha.dat 12 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/AOMix-FO.txt 7 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/AOMix-MPA-fr2.txt 7 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/AOMix-MPA-fr2-DOS-line.txt 4 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/AOMix-MPA-fr2-OPDOS-line.txt 3 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/whole.inp 605 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/fragm1.inp 537 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Q-Chem-3.2-BH3CO/fragm2.inp 380 B
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-MPA-fr2-DOS.txt 28 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-MPA-fr2-OPDOS.txt 15 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/BH3CO.txt 12 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-MO-FO-alpha.txt 10 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/fragm2.log 7 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/fragm1.log 6 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-FO.txt 6 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-MPA-fr2.txt 3 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-MO-FO-alpha-a1.dat 2 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-MPA-fr2-DOS-line.txt 1 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-MO-FO-alpha-e.dat 1 KB
AOMix/EXAMPLES/EXAMPLES-Fragment-Orbital-Calculations (CDA, EDA, etc.)/Spartan08/AOMix-MPA-fr2-OPDOS-line.txt 945 B
AOMix/EXAMPLES/Spartan/CO_res_closed.log 29 KB
AOMix/EXAMPLES/Spartan/AOMix-MPA-fr2-DOS.txt 27 KB
AOMix/EXAMPLES/Spartan/AOMix-MPA-fr2-OPDOS.txt 15 KB
AOMix/EXAMPLES/Spartan/AOMix-MPA-orb.txt 11 KB
AOMix/EXAMPLES/Spartan/AOMix-MPA-fr2.txt 5 KB
AOMix/EXAMPLES/Spartan/AOMix-fr2.txt 5 KB
AOMix/EXAMPLES/Spartan/AOMix-MPA-fr2-DOS-line.txt 2 KB
AOMix/EXAMPLES/Spartan/AOMix-fr2-chimera.txt 2 KB
AOMix/EXAMPLES/Spartan/AOMix-MPA-fr2-OPDOS-line.txt 2 KB
AOMix/EXAMPLES/Spartan/AOMix-fr2-chimera2.txt 46 B
AOMix/EXAMPLES/Spartan/CO.dat 32 B
AOMix/EXAMPLES/Turbomole/aomix.in 4.4 MB
AOMix/EXAMPLES/Turbomole/AOMix-MPA-orb.txt 527 KB
AOMix/EXAMPLES/Turbomole/AOMix-MPA-atom-OPDOS.txt 359 KB
AOMix/EXAMPLES/Turbomole/AOMix-MPA-atom-OPDOS-line.txt 310 KB
AOMix/EXAMPLES/Turbomole/AOMix-MPA-atom.txt 194 KB
AOMix/EXAMPLES/Turbomole/AOMix-MPA-atom-DOS.txt 76 KB
AOMix/EXAMPLES/Turbomole/AOMix-MPA-atom-DOS-line.txt 64 KB
AOMix/EXAMPLES/Turbomole/AOMix-atom.txt 23 KB
AOMix/EXAMPLES/Turbomole/AOMix-atom-chimera.txt 8 KB
AOMix/EXAMPLES/Turbomole/AOMix-atom-chimera2.txt 555 B
AOMix/AOMix-manual.pdf 2.4 MB
AOMix/AOMix-FO.exe 792 KB
AOMix/AOMix-L.exe 760 KB
AOMix/AOMix-S.exe 592 KB
AOMix/AOMix-p11.exe 460 KB
AOMix/AOMix.exe 436 KB
AOMix/AOMix-p1.exe 380 KB
AOMix/aomix-p9.exe 380 KB
AOMix/AOMIX-P8.EXE 87 KB
AOMix/aomixpar.txt 2 KB
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udp://tracker.zer0day.to:1337/announce
udp://tracker.coppersurfer.tk:6969/announce
udp://tracker.leechers-paradise.org:6969/announce
udp://tracker.internetwarriors.net:1337/announce
udp://mgtracker.org:6969/announce
udp://explodie.org:6969/announce
Name Size Peers
AOMix Other 63.5 MB 2

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