文件名称:g03_man
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- 上传时间:2012-11-16
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gaussian is a complex package for performing ab-initio quantum-mechanical molecular dynamics (MD) simulations
using pseudopotentials or the projector-augmented wave method and a plane wave basis set.
using pseudopotentials or the projector-augmented wave method and a plane wave basis set.
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下载文件列表
g03_man/
g03_man/.DS_Store
g03_man/._.DS_Store
g03_man/g_bars/
g03_man/g_bars/663399_template.jpg
g03_man/g_bars/9966CC_template.jpg
g03_man/g_bars/_notes/
g03_man/g_bars/_notes/dwsync.xml
g03_man/g_bars/about_g98.jpg
g03_man/g_bars/about_gauss_sca.jpg
g03_man/g_bars/about_gv3.jpg
g03_man/g_bars/ac_name.jpg
g03_man/g_bars/acad_binary_version_fees.jpg
g03_man/g_bars/add_basis_sets.jpg
g03_man/g_bars/add_cit_rec.jpg
g03_man/g_bars/add_info.jpg
g03_man/g_bars/add_jobs_steps.jpg
g03_man/g_bars/add_option_polar.jpg
g03_man/g_bars/add_ship_info.jpg
g03_man/g_bars/addit_job_steps_wind.jpg
g03_man/g_bars/address_phone.jpg
g03_man/g_bars/alpha_linux_vers.jpg
g03_man/g_bars/alt_forms.jpg
g03_man/g_bars/anisotropic_hyper.jpg
g03_man/g_bars/announcing_g03_gv3.jpg
g03_man/g_bars/answer.jpg
g03_man/g_bars/avail.jpg
g03_man/g_bars/avail_restrictions.jpg
g03_man/g_bars/availability.jpg
g03_man/g_bars/avres.jpg
g03_man/g_bars/ayc_name.jpg
g03_man/g_bars/basis_set_clar.jpg
g03_man/g_bars/basis_set_limit.jpg
g03_man/g_bars/basis_sets.jpg
g03_man/g_bars/basis_sets_green.jpg
g03_man/g_bars/batch_proc_gjob_files.jpg
g03_man/g_bars/benefis_stud.jpg
g03_man/g_bars/bio_info.jpg
g03_man/g_bars/bldg_fujitsu.jpg
g03_man/g_bars/bldg_prog_rs6000.jpg
g03_man/g_bars/calc_results.jpg
g03_man/g_bars/calibration_studies.jpg
g03_man/g_bars/casscf_eff.jpg
g03_man/g_bars/citation.jpg
g03_man/g_bars/conferences.jpg
g03_man/g_bars/config_gauss_exec.jpg
g03_man/g_bars/contact_ginc.jpg
g03_man/g_bars/control_mem_usage.jpg
g03_man/g_bars/contruct_zmatrices.jpg
g03_man/g_bars/default_mem.jpg
g03_man/g_bars/definitions.jpg
g03_man/g_bars/dep_features.jpg
g03_man/g_bars/desc.jpg
g03_man/g_bars/description.jpg
g03_man/g_bars/disp_pref.jpg
g03_man/g_bars/dl_name.jpg
g03_man/g_bars/e_g_f.jpg
g03_man/g_bars/edit_pref.jpg
g03_man/g_bars/eff_considerations.jpg
g03_man/g_bars/eff_improv.jpg
g03_man/g_bars/eg.jpg
g03_man/g_bars/email_addresses.jpg
g03_man/g_bars/email_czar.jpg
g03_man/g_bars/email_ed_gauss_news.jpg
g03_man/g_bars/email_expl_chem.jpg
g03_man/g_bars/email_gaussinc.jpg
g03_man/g_bars/email_pending_order.jpg
g03_man/g_bars/email_req_help.jpg
g03_man/g_bars/email_req_info.jpg
g03_man/g_bars/email_sent.jpg
g03_man/g_bars/email_wrkshp_coord.jpg
g03_man/g_bars/enhance_util_prog.jpg
g03_man/g_bars/error_form.jpg
g03_man/g_bars/est_calc_mem.jpg
g03_man/g_bars/examples.jpg
g03_man/g_bars/excited_states.jpg
g03_man/g_bars/exerc_3.jpg
g03_man/g_bars/exerc_5.jpg
g03_man/g_bars/exp_chem.jpg
g03_man/g_bars/exp_chem_2nd.jpg
g03_man/g_bars/faq.jpg
g03_man/g_bars/faqs.jpg
g03_man/g_bars/file_menu.jpg
g03_man/g_bars/find_out_more.jpg
g03_man/g_bars/fnd_alg.jpg
g03_man/g_bars/fortran_comp.jpg
g03_man/g_bars/func_diff_03_98.jpg
g03_man/g_bars/func_diff_98_94.jpg
g03_man/g_bars/fund_theory.jpg
g03_man/g_bars/fut_conferences.jpg
g03_man/g_bars/g03_ input_overview.jpg
g03_man/g_bars/g03_acad_china.jpg
g03_man/g_bars/g03_acad_pr.jpg
g03_man/g_bars/g03_avail_vers.jpg
g03_man/g_bars/g03_comm_china.jpg
g03_man/g_bars/g03_comm_pr.jpg
g03_man/g_bars/g03_help_table.jpg
g03_man/g_bars/g03_jobtypes.jpg
g03_man/g_bars/g03_usgov_pr.jpg
g03_man/g_bars/g03im_acad_china.jpg
g03_man/g_bars/G03m.jpg
g03_man/g_bars/g03m_acad_china.jpg
g03_man/g_bars/G03m_acad_pr.jpg
g03_man/g_bars/g03m_comm_china.jpg
g03_man/g_bars/g03m_comm_pr.jpg
g03_man/g_bars/g03m_feat.jpg
g03_man/g_bars/g03m_usgov_pr.jpg
g03_man/g_bars/G03w.jpg
g03_man/g_bars/g03w_acad_china.jpg
g03_man/g_bars/g03w_acad_pr.jpg
g03_man/g_bars/g03w_comm_china.jpg
g03_man/g_bars/g03w_comm_pr.jpg
g03_man/g_bars/g03w_feat.jpg
g03_man/g_bars/g03w_usgov_pr.jpg
g03_man/g_bars/g3_methods.jpg
g03_man/g_bars/g98_doc_set.jpg
g03_man/g_bars/g98_inst_notes.jpg
g03_man/g_bars/g98_online_help.jpg
g03_man/g_bars/g98wm_online_reg.jpg
g03_man/g_bars/gauss_gaussv.jpg
g03_man/g_bars/gauss_links.jpg
g03_man/g_bars/gauss_online_reg.jpg
g03_man/g_bars/gauss_sales_agnts.jpg
g03_man/g_bars/gaussvieww.jpg
g03_man/g_bars/gen_rules_return_items.jpg
g03_man/g_bars/geo_opt.jpg
g03_man/g_bars/getting_started.jpg
g03_man/g_bars/gv3.jpg
g03_man/g_bars/gv_acad_china.jpg
g03_man/g_bars/gv_acad_pr.jpg
g03_man/g_bars/gv_citation.jpg
g03_man/g_bars/gv_comm_china.jpg
g03_man/g_bars/gv_comm_pr.jpg
g03_man/g_bars/GV_features_glance.jpg
g03_man/g_bars/gv_usgov_pr.jpg
g03_man/g_bars/gvm.jpg
g03_man/g_bars/gvm_acad_china.jpg
g03_man/g_bars/gvm_acad_pr copy.jpg
g03_man/g_bars/gvm_acad_pr.jpg
g03_man/g_bars/gvm_comm_china.jpg
g03_man/g_bars/gvm_comm_pr.jpg
g03_man/g_bars/gvm_feat.jpg
g03_man/g_bars/gvm_usgov_pr.jpg
g03_man/g_bars/gvw_acad_china.jpg
g03_man/g_bars/gvw_acad_pr.jpg
g03_man/g_bars/gvw_comm_china.jpg
g03_man/g_bars/gvw_comm_pr.jpg
g03_man/g_bars/gvw_feat.jpg
g03_man/g_bars/gvw_usgov_pr.jpg
g03_man/g_bars/higher_correl.jpg
g03_man/g_bars/highly_effic_parallel.jpg
g03_man/g_bars/hot_stuff.jpg
g03_man/g_bars/info_place_orders.jpg
g03_man/g_bars/input_syn.jpg
g03_man/g_bars/insignif_output_reva4.jpg
g03_man/g_bars/install_notes.jpg
g03_man/g_bars/integ_prog.jpg
g03_man/g_bars/interface_cosmosrs.jpg
g03_man/g_bars/introg03.jpg
g03_man/g_bars/invest_lrg.jpg
g03_man/g_bars/iops.jpg
g03_ma
g03_man/.DS_Store
g03_man/._.DS_Store
g03_man/g_bars/
g03_man/g_bars/663399_template.jpg
g03_man/g_bars/9966CC_template.jpg
g03_man/g_bars/_notes/
g03_man/g_bars/_notes/dwsync.xml
g03_man/g_bars/about_g98.jpg
g03_man/g_bars/about_gauss_sca.jpg
g03_man/g_bars/about_gv3.jpg
g03_man/g_bars/ac_name.jpg
g03_man/g_bars/acad_binary_version_fees.jpg
g03_man/g_bars/add_basis_sets.jpg
g03_man/g_bars/add_cit_rec.jpg
g03_man/g_bars/add_info.jpg
g03_man/g_bars/add_jobs_steps.jpg
g03_man/g_bars/add_option_polar.jpg
g03_man/g_bars/add_ship_info.jpg
g03_man/g_bars/addit_job_steps_wind.jpg
g03_man/g_bars/address_phone.jpg
g03_man/g_bars/alpha_linux_vers.jpg
g03_man/g_bars/alt_forms.jpg
g03_man/g_bars/anisotropic_hyper.jpg
g03_man/g_bars/announcing_g03_gv3.jpg
g03_man/g_bars/answer.jpg
g03_man/g_bars/avail.jpg
g03_man/g_bars/avail_restrictions.jpg
g03_man/g_bars/availability.jpg
g03_man/g_bars/avres.jpg
g03_man/g_bars/ayc_name.jpg
g03_man/g_bars/basis_set_clar.jpg
g03_man/g_bars/basis_set_limit.jpg
g03_man/g_bars/basis_sets.jpg
g03_man/g_bars/basis_sets_green.jpg
g03_man/g_bars/batch_proc_gjob_files.jpg
g03_man/g_bars/benefis_stud.jpg
g03_man/g_bars/bio_info.jpg
g03_man/g_bars/bldg_fujitsu.jpg
g03_man/g_bars/bldg_prog_rs6000.jpg
g03_man/g_bars/calc_results.jpg
g03_man/g_bars/calibration_studies.jpg
g03_man/g_bars/casscf_eff.jpg
g03_man/g_bars/citation.jpg
g03_man/g_bars/conferences.jpg
g03_man/g_bars/config_gauss_exec.jpg
g03_man/g_bars/contact_ginc.jpg
g03_man/g_bars/control_mem_usage.jpg
g03_man/g_bars/contruct_zmatrices.jpg
g03_man/g_bars/default_mem.jpg
g03_man/g_bars/definitions.jpg
g03_man/g_bars/dep_features.jpg
g03_man/g_bars/desc.jpg
g03_man/g_bars/description.jpg
g03_man/g_bars/disp_pref.jpg
g03_man/g_bars/dl_name.jpg
g03_man/g_bars/e_g_f.jpg
g03_man/g_bars/edit_pref.jpg
g03_man/g_bars/eff_considerations.jpg
g03_man/g_bars/eff_improv.jpg
g03_man/g_bars/eg.jpg
g03_man/g_bars/email_addresses.jpg
g03_man/g_bars/email_czar.jpg
g03_man/g_bars/email_ed_gauss_news.jpg
g03_man/g_bars/email_expl_chem.jpg
g03_man/g_bars/email_gaussinc.jpg
g03_man/g_bars/email_pending_order.jpg
g03_man/g_bars/email_req_help.jpg
g03_man/g_bars/email_req_info.jpg
g03_man/g_bars/email_sent.jpg
g03_man/g_bars/email_wrkshp_coord.jpg
g03_man/g_bars/enhance_util_prog.jpg
g03_man/g_bars/error_form.jpg
g03_man/g_bars/est_calc_mem.jpg
g03_man/g_bars/examples.jpg
g03_man/g_bars/excited_states.jpg
g03_man/g_bars/exerc_3.jpg
g03_man/g_bars/exerc_5.jpg
g03_man/g_bars/exp_chem.jpg
g03_man/g_bars/exp_chem_2nd.jpg
g03_man/g_bars/faq.jpg
g03_man/g_bars/faqs.jpg
g03_man/g_bars/file_menu.jpg
g03_man/g_bars/find_out_more.jpg
g03_man/g_bars/fnd_alg.jpg
g03_man/g_bars/fortran_comp.jpg
g03_man/g_bars/func_diff_03_98.jpg
g03_man/g_bars/func_diff_98_94.jpg
g03_man/g_bars/fund_theory.jpg
g03_man/g_bars/fut_conferences.jpg
g03_man/g_bars/g03_ input_overview.jpg
g03_man/g_bars/g03_acad_china.jpg
g03_man/g_bars/g03_acad_pr.jpg
g03_man/g_bars/g03_avail_vers.jpg
g03_man/g_bars/g03_comm_china.jpg
g03_man/g_bars/g03_comm_pr.jpg
g03_man/g_bars/g03_help_table.jpg
g03_man/g_bars/g03_jobtypes.jpg
g03_man/g_bars/g03_usgov_pr.jpg
g03_man/g_bars/g03im_acad_china.jpg
g03_man/g_bars/G03m.jpg
g03_man/g_bars/g03m_acad_china.jpg
g03_man/g_bars/G03m_acad_pr.jpg
g03_man/g_bars/g03m_comm_china.jpg
g03_man/g_bars/g03m_comm_pr.jpg
g03_man/g_bars/g03m_feat.jpg
g03_man/g_bars/g03m_usgov_pr.jpg
g03_man/g_bars/G03w.jpg
g03_man/g_bars/g03w_acad_china.jpg
g03_man/g_bars/g03w_acad_pr.jpg
g03_man/g_bars/g03w_comm_china.jpg
g03_man/g_bars/g03w_comm_pr.jpg
g03_man/g_bars/g03w_feat.jpg
g03_man/g_bars/g03w_usgov_pr.jpg
g03_man/g_bars/g3_methods.jpg
g03_man/g_bars/g98_doc_set.jpg
g03_man/g_bars/g98_inst_notes.jpg
g03_man/g_bars/g98_online_help.jpg
g03_man/g_bars/g98wm_online_reg.jpg
g03_man/g_bars/gauss_gaussv.jpg
g03_man/g_bars/gauss_links.jpg
g03_man/g_bars/gauss_online_reg.jpg
g03_man/g_bars/gauss_sales_agnts.jpg
g03_man/g_bars/gaussvieww.jpg
g03_man/g_bars/gen_rules_return_items.jpg
g03_man/g_bars/geo_opt.jpg
g03_man/g_bars/getting_started.jpg
g03_man/g_bars/gv3.jpg
g03_man/g_bars/gv_acad_china.jpg
g03_man/g_bars/gv_acad_pr.jpg
g03_man/g_bars/gv_citation.jpg
g03_man/g_bars/gv_comm_china.jpg
g03_man/g_bars/gv_comm_pr.jpg
g03_man/g_bars/GV_features_glance.jpg
g03_man/g_bars/gv_usgov_pr.jpg
g03_man/g_bars/gvm.jpg
g03_man/g_bars/gvm_acad_china.jpg
g03_man/g_bars/gvm_acad_pr copy.jpg
g03_man/g_bars/gvm_acad_pr.jpg
g03_man/g_bars/gvm_comm_china.jpg
g03_man/g_bars/gvm_comm_pr.jpg
g03_man/g_bars/gvm_feat.jpg
g03_man/g_bars/gvm_usgov_pr.jpg
g03_man/g_bars/gvw_acad_china.jpg
g03_man/g_bars/gvw_acad_pr.jpg
g03_man/g_bars/gvw_comm_china.jpg
g03_man/g_bars/gvw_comm_pr.jpg
g03_man/g_bars/gvw_feat.jpg
g03_man/g_bars/gvw_usgov_pr.jpg
g03_man/g_bars/higher_correl.jpg
g03_man/g_bars/highly_effic_parallel.jpg
g03_man/g_bars/hot_stuff.jpg
g03_man/g_bars/info_place_orders.jpg
g03_man/g_bars/input_syn.jpg
g03_man/g_bars/insignif_output_reva4.jpg
g03_man/g_bars/install_notes.jpg
g03_man/g_bars/integ_prog.jpg
g03_man/g_bars/interface_cosmosrs.jpg
g03_man/g_bars/introg03.jpg
g03_man/g_bars/invest_lrg.jpg
g03_man/g_bars/iops.jpg
g03_ma
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