diff --git a/nwchemusermanual.pdf b/nwchemusermanual.pdf index 0f02f1d098..3d063c387c 100644 Binary files a/nwchemusermanual.pdf and b/nwchemusermanual.pdf differ diff --git a/sitemap.xml b/sitemap.xml index e77306788c..d63899e53f 100644 --- a/sitemap.xml +++ b/sitemap.xml @@ -2,1977 +2,1977 @@ https://nwchemgit.github.io/index.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/1D-RISM.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ARMCI.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Aba2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Abm2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ama2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Amm2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Analysis.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Archived-Forum.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/AvailableBasisSets.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Basis.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Benchmarks.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Bq.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/C2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/C222.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/C222_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/C2Sc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/C2Sm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/CCCA_method.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/CCSD.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/COSMO-Solvation-Model.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Capabilities.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cartesian-coordinate-input.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ccc2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ccca.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cccm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Charge.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Citation.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Classical-Methods.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cmc2_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cmca.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cmcm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cmm2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cmma.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Cmmm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Compiling-NWChem.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Constraints.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Containers.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Current_events.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/DNTMC.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/DPLOT.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Density-Functional-Theory-for-Molecules.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Density-Functional-Theory-for-Molecules_bibtext.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Developer.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Developer_Team.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Download.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ECCE_PRINT.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ECHO.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ECP.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/EMSL_Arrows.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/EPR-pNMR.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ESP.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Electron-Transfer.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Electronic-Structure-Analysis.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Examples.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Excited-State-Calculations.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/F-43c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/F-43m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/F222.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/F23.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/F432.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/F4_132.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/FAQ.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/FCIDUMP.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fd-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fd-3c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fd-3m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fdd2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fddd.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fm-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fm-3c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fm-3m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fmm2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Fmmm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Format_of_MD_Files.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Forum.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Forum_search.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Forum_search2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/GW.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Gaussian-Basis-AIMD.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Geometry-Optimization.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Geometry-examples.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Geometry-load.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Geometry.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Getting-Started.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Guidelines-for-Authors.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Hartree-Fock-Theory-for-Molecules.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Hessians-and-Vibrational-Frequencies.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Home.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Hybrid-Approaches.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I-4.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I-42d.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I-42m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I-43d.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I-43m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I-4c2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I-4m2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I222.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I23.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I2_12_12_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I2_13.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I422.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I432.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4Sm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4Smcm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4Smmm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4_122.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4_132.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4_1Sa.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4_1Sacd.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4_1cd.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4_1md.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4cm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/I4mm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ia-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ia-3d.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Iba2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ibam.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ibca.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Im-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Im-3m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ima2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Imm2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Imma.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Immm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Interface.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Interfaces-with-External-Software.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Introduction.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Keywords-on-the-GEOMETRY-directive.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Known-Bugs.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/MD.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/MM_Parameters.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/MP2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Memory.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Multiconfiguration_SCF.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/NWChem-Architecture.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Names-of-3-dimensional-space-groups.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Nudged-Elastic-Band-and-Zero-Temperature-String-Methods.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ONIOM.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Ongoing_Projects.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Other-Capabilities.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Overview.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-31c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-31m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-3c1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-3m1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-4.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-42_1c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-42_1m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-42c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-42m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-43m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-43n.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-4b2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-4c2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-4m2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-4n2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-6.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-62c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-62m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-6c2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P-6m2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P222.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P222_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P23.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2Sc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2Sm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2_12_12.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2_12_12_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2_13.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2_1Sc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P2_1Sm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P312.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P31c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P31m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P321.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3_112.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3_121.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3_2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3_212.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3_221.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3c1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P3m1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P422.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P42_12.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P432.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Sm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Smbm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Smcc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Smmm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Smnc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Sn.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Snbm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Sncc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Snmm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4Snnc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_122.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_12_12.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_132.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_222.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_22_12.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_232.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Sm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Smbc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Smcm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Smmc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Smnm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Sn.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Snbc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Sncm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Snmc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2Snnm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2bc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2cm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2mc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_2nm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_322.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_32_12.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4_332.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4bm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4cc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4mm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P4nc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P622.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6Sm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6Smcc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6Smmm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_122.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_222.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_322.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_3Sm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_3Smcm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_3Smmc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_3cm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_3mc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_4.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_422.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_5.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6_522.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6cc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/P6mm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/PDF.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pa-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pba2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pbam.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pban.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pbca.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pbcm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pbcn.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pc.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pca2_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pcc2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pcca.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pccm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pccn.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Permanent_Dir.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Plane-Wave-Density-Functional-Theory.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pm-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pm-3m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pm-3n.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pma2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pmc2_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pmm2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pmma.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pmmm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pmmn.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pmn2_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pmna.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pn-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pn-3m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pn-3n.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pna2_1.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pnc2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pnma.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pnn2.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pnna.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pnnm.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Pnnn.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Potential-Energy-Surface-Analysis.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Prepare.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Print_Noprint.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Properties.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Python.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Appendix.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Dynamics.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_ESP.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Excited_States.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_FEP_Example.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Free_Energy.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Input_File.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_MM_Parameters.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Parameters.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Preparation_Prerequisites.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_QMMM_Parameters.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_QM_Parameters.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_References.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Restart_and_Topology_Files.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QMMM_Transition_States.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/QM_Parameters.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_NEB_Calculations.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_convergence.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_density.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_freq.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_maxiter.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_ncycles.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_nsamples.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_optimization.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_preparation_basic.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_preparation_constraints.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_preparation_solvation.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_region.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_rename.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Qmmm_xyz.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Quantum-Mechanical-Methods.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Quantum-Molecular-Dynamics.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Quantum.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/R-3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/R-3c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/R-3m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/R3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/R32.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/R3c.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/R3m.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/RT-TDDFT.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Relativistic-All-electron-Approximations.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Running.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/SELCI.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/SET.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/SMD-Model.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/STOP.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/SYMMETRY----Symmetry-Group-Input.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/SYSTEM----Lattice-parameters-for-periodic-systems.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Sample.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Scratch_Dir.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Software-supporting-NWChem.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Solvation-Models.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Start_Restart.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Supplementary-Information.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/System-Description.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/TASK.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/TCE.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/TITLE.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Top-level.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Tutorial-Athens2018.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Tutorial-Slides.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Tutorials.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/UNSET.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/VEM-Model.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/VSCF.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/Vibration.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ZCOORD-Forcing-internal-coordinates.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ZMATRIX-Z-matrix-input.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/ZMATRIX.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/_Footer.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/_Sidebar.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/mepgs.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/projects.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_bq_zone.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_eref.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_example3.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_example6.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_example7.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_introduction.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_link_atoms.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_link_ecp.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_load.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_method.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_mm_charges.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_sp_energy.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/qmmm_sp_property.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/stub.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/tropt.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/tut2019/index.html - 2023-05-28 + 2023-05-29 daily https://nwchemgit.github.io/tutorial_singapore2012/index.html - 2023-05-28 + 2023-05-29 daily \ No newline at end of file diff --git a/sitemap.xml.gz b/sitemap.xml.gz index 0593bea250..d17fe310cb 100644 Binary files a/sitemap.xml.gz and b/sitemap.xml.gz differ