drjack.world
Google Keyword Rankings for : example gaussian input file
1
https://www.cup.uni-muenchen.de/ch/compchem/basic/g03input.html
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https://www.cup.uni-muenchen.de/ch/compchem/basic/g03input.html
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2
https://gaussian.com/input/
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https://gaussian.com/input/
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3
https://emleddin.github.io/comp-chem-website/Otherguide-gaussian-input.html
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https://emleddin.github.io/comp-chem-website/Otherguide-gaussian-input.html
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4
http://www.hpc.unm.edu/~chem/gaussian/zmats.html
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http://www.hpc.unm.edu/~chem/gaussian/zmats.html
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5
https://math.nist.gov/mcsd/savg/tutorial/ex.html
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https://math.nist.gov/mcsd/savg/tutorial/ex.html
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6
https://personal.us.es/galindo/GaussFiles.pdf
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https://personal.us.es/galindo/GaussFiles.pdf
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7
http://thiele.ruc.dk/~spanget/help/g09/m_input.htm
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http://thiele.ruc.dk/~spanget/help/g09/m_input.htm
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8
http://www.ccl.net/cca/documents/dyoung/topics-orig/gaussian.html
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http://www.ccl.net/cca/documents/dyoung/topics-orig/gaussian.html
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9
https://barrett-group.mcgill.ca/tutorials/Gaussian%20tutorial.pdf
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https://barrett-group.mcgill.ca/tutorials/Gaussian%20tutorial.pdf
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10
https://www.youtube.com/watch?v=35xFvh1yPec
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https://www.youtube.com/watch?v=35xFvh1yPec
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11
https://docs.eyesopen.com/floe/modules/gaussian-cubes/docs/source/tutorials/run_input_success.html
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https://docs.eyesopen.com/floe/modules/gaussian-cubes/docs/source/tutorials/run_input_success.html
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12
https://gist.github.com/2136273
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https://gist.github.com/2136273
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13
https://www.ionicviper.org/system/files/Anatomy%20of%20a%20Gaussian%20Input%20File.doc
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https://www.ionicviper.org/system/files/Anatomy%20of%20a%20Gaussian%20Input%20File.doc
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14
https://www.osc.edu/book/export/html/5211
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https://www.osc.edu/book/export/html/5211
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15
https://wanglab.hosted.uark.edu/g03guide/G03Guide/www.gaussian.com/g_ur/m_input.htm
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https://wanglab.hosted.uark.edu/g03guide/G03Guide/www.gaussian.com/g_ur/m_input.htm
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16
https://wordpress.nmsu.edu/tmanz/notes-on-generating-wfx-files-for-gaussian-jobs/
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https://wordpress.nmsu.edu/tmanz/notes-on-generating-wfx-files-for-gaussian-jobs/
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17
https://hpc-uit.readthedocs.io/en/latest/applications/chemistry/Gaussian/job-example.html
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https://hpc-uit.readthedocs.io/en/latest/applications/chemistry/Gaussian/job-example.html
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18
https://dornshuld.chemistry.msstate.edu/comp-chem/first-gaussian-job/
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https://dornshuld.chemistry.msstate.edu/comp-chem/first-gaussian-job/
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19
https://www.msi.umn.edu/sites/default/files/IntroToGaussian09.pdf
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https://www.msi.umn.edu/sites/default/files/IntroToGaussian09.pdf
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20
https://usdrcg.gitbook.io/docs/practice/about-legacy/gaussian
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https://usdrcg.gitbook.io/docs/practice/about-legacy/gaussian
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21
https://chem4.cns.uaf.edu/webmo2/g09ur-old/m_input.htm
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https://chem4.cns.uaf.edu/webmo2/g09ur-old/m_input.htm
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22
http://gohom.win/ManualHom/Gaussian/G09W/help/jobs.htm
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http://gohom.win/ManualHom/Gaussian/G09W/help/jobs.htm
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23
https://docs.chemaxon.com/display/docs/gaussian-input-output-format.md
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https://docs.chemaxon.com/display/docs/gaussian-input-output-format.md
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24
http://pogorelov.scs.illinois.edu/wp-content/uploads/2020/06/qm-gaussian-intro-2-tutorial-PogorelovLab.2011.v1.web_.pdf
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http://pogorelov.scs.illinois.edu/wp-content/uploads/2020/06/qm-gaussian-intro-2-tutorial-PogorelovLab.2011.v1.web_.pdf
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25
https://mattermodeling.stackexchange.com/questions/9421/gaussian-job-file-with-variables-and-link1
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https://mattermodeling.stackexchange.com/questions/9421/gaussian-job-file-with-variables-and-link1
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26
https://www.researchgate.net/post/How-can-i-create-an-input-file-for-optimization-in-Gaussian-G09-for-my-molecule
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https://www.researchgate.net/post/How-can-i-create-an-input-file-for-optimization-in-Gaussian-G09-for-my-molecule
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27
https://sites.uw.edu/yueliu96/process-gaussian-optimization-output/
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https://sites.uw.edu/yueliu96/process-gaussian-optimization-output/
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28
http://explor-tech.univ-lorraine.fr/en/Gaussian09/
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http://explor-tech.univ-lorraine.fr/en/Gaussian09/
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29
https://www.tau.ac.il/~ephraim/Gaussian_manual.pdf
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https://www.tau.ac.il/~ephraim/Gaussian_manual.pdf
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30
https://wiki.fysik.dtu.dk/ase/ase/calculators/gaussian.html
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https://wiki.fysik.dtu.dk/ase/ase/calculators/gaussian.html
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31
https://pubs.acs.org/doi/10.1021/acs.jchemed.1c00515
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https://pubs.acs.org/doi/10.1021/acs.jchemed.1c00515
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32
http://forum.psicode.org/t/sapt-calculation-input-file-from-gaussian-log-file/2427
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http://forum.psicode.org/t/sapt-calculation-input-file-from-gaussian-log-file/2427
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33
http://ruanwuzhi.itp.ac.cn/c/document_library/get_file?uuid=ca779893-1fb3-40cb-a963-38aa6e9a55b8&groupId=24021
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http://ruanwuzhi.itp.ac.cn/c/document_library/get_file?uuid=ca779893-1fb3-40cb-a963-38aa6e9a55b8&groupId=24021
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34
https://confluence.csuc.cat/display/HPCKB/How+to+run+a+Gaussian+optimization
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https://confluence.csuc.cat/display/HPCKB/How+to+run+a+Gaussian+optimization
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35
http://www1.udel.edu/chem/computing/newzmat.html
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http://www1.udel.edu/chem/computing/newzmat.html
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36
https://gitlab.com/ase/ase/-/merge_requests/2278
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https://gitlab.com/ase/ase/-/merge_requests/2278
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37
https://ccportal.ims.ac.jp/en/node/2848
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https://ccportal.ims.ac.jp/en/node/2848
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38
https://pymatgen.org/pymatgen.io.gaussian.html
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https://pymatgen.org/pymatgen.io.gaussian.html
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39
https://hpc.chem.wisc.edu/software/sunbird-software/gaussian/
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https://hpc.chem.wisc.edu/software/sunbird-software/gaussian/
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40
https://hpc-wiki.info/hpc/Gaussian
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https://hpc-wiki.info/hpc/Gaussian
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41
https://answers.uillinois.edu/scs/page.php?id=103204
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https://answers.uillinois.edu/scs/page.php?id=103204
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42
https://wiki.bwhpc.de/e/JUSTUS2/Software/Gaussian
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https://wiki.bwhpc.de/e/JUSTUS2/Software/Gaussian
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43
https://assets.researchsquare.com/files/nprot-3143/v2/6c6d74e8-0b77-4585-86de-de232c6ae34f.pdf
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https://assets.researchsquare.com/files/nprot-3143/v2/6c6d74e8-0b77-4585-86de-de232c6ae34f.pdf
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44
https://www.nrel.gov/hpc/eagle-software-gaussian.html
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https://www.nrel.gov/hpc/eagle-software-gaussian.html
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45
http://marquetand.net/index.php/blog/48-gaussian-input-with-ecp
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http://marquetand.net/index.php/blog/48-gaussian-input-with-ecp
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46
https://flex.phys.tohoku.ac.jp/texi/gview/setup.htm
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https://flex.phys.tohoku.ac.jp/texi/gview/setup.htm
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47
https://sites.google.com/site/rangsiman1993/comp-chem/techniques/learn-comp-chem-with-gaussian
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https://sites.google.com/site/rangsiman1993/comp-chem/techniques/learn-comp-chem-with-gaussian
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48
https://www.cwu.edu/chemistry/sites/cts.cwu.edu.chemistry/files/documents/Gaussian_09_ReferenceManual.pdf
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https://www.cwu.edu/chemistry/sites/cts.cwu.edu.chemistry/files/documents/Gaussian_09_ReferenceManual.pdf
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49
https://hcc.unl.edu/docs/applications/app_specific/running_gaussian_at_hcc/
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https://hcc.unl.edu/docs/applications/app_specific/running_gaussian_at_hcc/
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50
https://thesis.library.caltech.edu/7086/36/Sprague_Matthew_Thesis_App_C.pdf
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https://thesis.library.caltech.edu/7086/36/Sprague_Matthew_Thesis_App_C.pdf
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51
https://biosim.pt/2019/02/18/molup-tutorial-2-load-a-gaussian-output-and-prepare-a-scan/
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https://biosim.pt/2019/02/18/molup-tutorial-2-load-a-gaussian-output-and-prepare-a-scan/
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52
https://docs.rnet.missouri.edu/software/gaussian/
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https://docs.rnet.missouri.edu/software/gaussian/
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53
https://ccse.jaea.go.jp/software/PIMD/doc/manual/node85.html
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https://ccse.jaea.go.jp/software/PIMD/doc/manual/node85.html
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54
https://cpb-us-e1.wpmucdn.com/blogs.cornell.edu/dist/1/3053/files/2019/10/Gaussian_optimization.pdf
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https://cpb-us-e1.wpmucdn.com/blogs.cornell.edu/dist/1/3053/files/2019/10/Gaussian_optimization.pdf
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55
https://wiki.hpc.odu.edu/Software/Gaussian
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https://wiki.hpc.odu.edu/Software/Gaussian
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56
https://researchcomputing.princeton.edu/support/knowledge-base/gaussian
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https://researchcomputing.princeton.edu/support/knowledge-base/gaussian
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57
https://www.echemi.com/community/how-to-create-gaussian-input-file-for-an-organic-molecule-with_mjart2204083772_238.html
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https://www.echemi.com/community/how-to-create-gaussian-input-file-for-an-organic-molecule-with_mjart2204083772_238.html
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58
https://www.uppmax.uu.se/support/user-guides/gaussian-09-user-guide/
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https://www.uppmax.uu.se/support/user-guides/gaussian-09-user-guide/
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59
http://zhjun-sci.com/abcluster/doc/eg-isomergs.html
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http://zhjun-sci.com/abcluster/doc/eg-isomergs.html
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60
https://www.conflex.net/manuals/tutorials/external_program.html
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https://www.conflex.net/manuals/tutorials/external_program.html
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61
http://schlegelgroup.wayne.edu/Software/oniomtoolTAO/TAOtutorial.html
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http://schlegelgroup.wayne.edu/Software/oniomtoolTAO/TAOtutorial.html
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62
http://www.chemistry4.me/Gaussian/G09W/help/u_newzmat.htm
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http://www.chemistry4.me/Gaussian/G09W/help/u_newzmat.htm
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63
https://www.pdc.kth.se/software/software/Gaussian/centos7/g09.D01/index_using.html
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https://www.pdc.kth.se/software/software/Gaussian/centos7/g09.D01/index_using.html
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64
http://bohr.chem.gac.edu/docs/g03man/g_ur/m_running.htm
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http://bohr.chem.gac.edu/docs/g03man/g_ur/m_running.htm
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65
https://chemistry.harvard.edu/gaussian-16
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https://chemistry.harvard.edu/gaussian-16
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66
https://arcdocs.leeds.ac.uk/software/applications/gaussian.html
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https://arcdocs.leeds.ac.uk/software/applications/gaussian.html
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67
http://wild.life.nctu.edu.tw/~jsyu/compchem/g09/g09ur/m_running.htm
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http://wild.life.nctu.edu.tw/~jsyu/compchem/g09/g09ur/m_running.htm
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68
https://www.theochem.ru.nl/molpro/molpro2006.1/doc/manual/node113.html
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https://www.theochem.ru.nl/molpro/molpro2006.1/doc/manual/node113.html
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69
https://its.unc.edu/wp-content/uploads/sites/337/2018/05/IntroductiontoGaussian_2010.ppt
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https://its.unc.edu/wp-content/uploads/sites/337/2018/05/IntroductiontoGaussian_2010.ppt
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70
https://hpc.ncsu.edu/Software/Apps.php?app=Gaussian
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https://hpc.ncsu.edu/Software/Apps.php?app=Gaussian
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71
https://www.rcac.purdue.edu/knowledge/bell/run/examples/apps/gaussian
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https://www.rcac.purdue.edu/knowledge/bell/run/examples/apps/gaussian
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72
https://joaquinbarroso.com/questions/
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https://joaquinbarroso.com/questions/
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73
https://www.nsc.liu.se/software/installed/tetralith/gaussian/
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https://www.nsc.liu.se/software/installed/tetralith/gaussian/
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74
https://wiki.hpc.rug.nl/peregrine/examples/gaussian
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https://wiki.hpc.rug.nl/peregrine/examples/gaussian
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75
http://www.huntresearchgroup.org.uk/teaching/teaching_comp_lab_year3/4c_mixed_pp_basis.html
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http://www.huntresearchgroup.org.uk/teaching/teaching_comp_lab_year3/4c_mixed_pp_basis.html
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76
http://www.shuaigroup.net/images/momap-docs/MOMAP_Tutorial_02_Irppy3.pdf
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http://www.shuaigroup.net/images/momap-docs/MOMAP_Tutorial_02_Irppy3.pdf
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77
https://wiki.cse.ucdavis.edu/support/hpc/software/gaussian
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https://wiki.cse.ucdavis.edu/support/hpc/software/gaussian
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78
https://documentation.sigma2.no/software/application_guides/gaussian/gaussian_job_example.html
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https://documentation.sigma2.no/software/application_guides/gaussian/gaussian_job_example.html
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79
https://janeskoresearchgroup.files.wordpress.com/2020/08/how-to-animate-molecules.pdf
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https://janeskoresearchgroup.files.wordpress.com/2020/08/how-to-animate-molecules.pdf
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80
https://cac.queensu.ca/wiki/index.php/HowTo:gaussian
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https://cac.queensu.ca/wiki/index.php/HowTo:gaussian
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81
https://repository.kaust.edu.sa/handle/10754/655596
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https://repository.kaust.edu.sa/handle/10754/655596
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82
https://www.chemissian.com/ch4
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https://www.chemissian.com/ch4
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83
https://www.x-mol.com/groups/Dong/news/816
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https://www.x-mol.com/groups/Dong/news/816
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84
https://docs.icer.msu.edu/Gaussian_Job_Script/
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https://docs.icer.msu.edu/Gaussian_Job_Script/
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85
https://wiki.orc.gmu.edu/mkdocs/Running_Gaussian/
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https://wiki.orc.gmu.edu/mkdocs/Running_Gaussian/
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86
https://hprc.tamu.edu/wiki/SW:Gaussian
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https://hprc.tamu.edu/wiki/SW:Gaussian
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87
http://www.ub.edu/bl/2017/03/16/small-molecule-dihedrals-parametrization/
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http://www.ub.edu/bl/2017/03/16/small-molecule-dihedrals-parametrization/
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88
https://scubeindia.com/wp-content/uploads/2021/02/What-New-G16C.01.pdf
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https://scubeindia.com/wp-content/uploads/2021/02/What-New-G16C.01.pdf
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89
http://hpc.loni.org/docs/guides/software.php?software=gaussian&machine=qb2
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http://hpc.loni.org/docs/guides/software.php?software=gaussian&machine=qb2
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90
http://chem.yu.edu.jo/rawash/chem%20495/modeling%20transition%20state%20in%20gaussian.pdf
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http://chem.yu.edu.jo/rawash/chem%20495/modeling%20transition%20state%20in%20gaussian.pdf
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91
http://ambermd.org/antechamber/ac.html
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http://ambermd.org/antechamber/ac.html
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92
https://hummingbird.ucsc.edu/software/gaussian-09/
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https://hummingbird.ucsc.edu/software/gaussian-09/
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93
https://www.rc.virginia.edu/userinfo/rivanna/software/gaussian/
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https://www.rc.virginia.edu/userinfo/rivanna/software/gaussian/
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94
https://www.quantum-espresso.org/Doc/INPUT_PW.html
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https://www.quantum-espresso.org/Doc/INPUT_PW.html
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95
https://kb.iu.edu/d/amtp
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https://kb.iu.edu/d/amtp
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96
http://www.chem.ubbcluj.ro/pagini/anorganica/isi/cmmcqc%20calculations/cmmcqc_g09_howto.pdf
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http://www.chem.ubbcluj.ro/pagini/anorganica/isi/cmmcqc%20calculations/cmmcqc_g09_howto.pdf
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97
https://wiki.hpcuser.uni-oldenburg.de/index.php?title=Gaussian_2016
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https://wiki.hpcuser.uni-oldenburg.de/index.php?title=Gaussian_2016
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98
https://www.reddit.com/r/chemistry/comments/bxvb3m/chemdraw_3d_ultra_gaussian_input/
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https://www.reddit.com/r/chemistry/comments/bxvb3m/chemdraw_3d_ultra_gaussian_input/
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