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Search.setIndex({"alltitles": {"About LITESOPH": [[3, "about-litesoph"]], "Absorption Spectrum": [[21, "absorption-spectrum"]], "Adding new engine": [[7, "adding-new-engine"]], "Adding new task": [[11, "adding-new-task"]], "Adding new workflow type": [[13, "adding-new-workflow-type"]], "Advanced": [[26, "advanced"]], "Available Features in LITESOPH": [[18, "available-features-in-litesoph"]], "Averaged Spectrum": [[32, "averaged-spectrum"]], "Basic": [[26, "basic"]], "Bugs!": [[0, "bugs"]], "Charge": [[43, "charge"]], "Class InputFrame": [[9, "class-inputframe"]], "Class TaskController": [[8, "class-taskcontroller"]], "Class View": [[9, "class-view"]], "Clone from an existing Workflow": [[44, "clone-from-an-existing-workflow"]], "Code Architecture": [[4, "code-architecture"]], "Code overview": [[5, "code-overview"]], "Coding Standards": [[6, "coding-standards"]], "Compute KSD": [[33, "compute-ksd"]], "Compute MO Population": [[35, "compute-mo-population"]], "Compute Spectrum": [[25, "compute-spectrum"]], "Compute TAS": [[28, "compute-tas"]], "Conda environment": [[6, "conda-environment"]], "Configuration": [[40, "configuration"]], "Contents": [[39, "contents"]], "Convergence": [[26, "convergence"]], "Create a Workflow": [[44, "create-a-workflow"]], "Create a new Project": [[44, "create-a-new-project"]], "Creating a new GUI frame": [[9, "creating-a-new-gui-frame"]], "Current Developers": [[41, "current-developers"]], "Defining a TaskController": [[8, "defining-a-taskcontroller"]], "Delta kick Inputs": [[31, "delta-kick-inputs"]], "Description of base-classes": [[7, "description-of-base-classes"], [11, "description-of-base-classes"]], "Development": [[5, "development"]], "Development topics": [[5, "development-topics"]], "Development workflow": [[6, "development-workflow"]], "Dipole moment analysis": [[29, "dipole-moment-analysis"]], "Documentation and Support:": [[42, "documentation-and-support"]], "Effects of spin-orbit interactions (upcoming)": [[22, "effects-of-spin-orbit-interactions-upcoming"]], "Engines": [[40, "engines"]], "Engines Interfaced with LITESOPH": [[3, "engines-interfaced-with-litesoph"]], "Environment": [[43, "environment"]], "Example lsconfig file": [[40, "example-lsconfig-file"]], "Examples": [[16, "examples"]], "Features": [[10, "features"], [24, "features"]], "Features and Functionalities": [[8, "features-and-functionalities"], [45, "features-and-functionalities"]], "Frequently Asked Questions": [[1, "frequently-asked-questions"]], "Functionalities": [[9, "functionalities"], [9, "id1"], [9, "id2"], [10, "functionalities"]], "Future Updates:": [[42, "future-updates"]], "GPAW": [[40, "gpaw"]], "GUI Control Modules": [[8, "gui-control-modules"]], "GUI View Modules": [[9, "gui-view-modules"]], "Getting the source code of LITESOPH": [[40, "getting-the-source-code-of-litesoph"]], "Ground State": [[26, "ground-state"]], "How to enable passwordless SSH?": [[1, "how-to-enable-passwordless-ssh"], [2, "how-to-enable-passwordless-ssh"]], "Independent Tasks Based": [[27, "independent-tasks-based"]], "Input File Description": [[14, "input-file-description"], [15, "input-file-description"]], "Installation Guide": [[40, "installation-guide"]], "Investigators": [[41, "investigators"]], "KSD": [[33, "ksd"]], "Kohn-Sham Decomposition (KSD)": [[21, "kohn-sham-decomposition-ksd"]], "LASER Masking approach to study energy transfer using RT-TDDFT approach": [[21, "laser-masking-approach-to-study-energy-transfer-using-rt-tddft-approach"]], "LASER Simulation": [[21, "laser-simulation"]], "LITESOPH Job Submission, Monitoring and File Management": [[10, "litesoph-job-submission-monitoring-and-file-management"], [45, "litesoph-job-submission-monitoring-and-file-management"]], "LITESOPH Visualization Toolkit": [[12, "litesoph-visualization-toolkit"], [47, "litesoph-visualization-toolkit"]], "Laser Design tools": [[31, "laser-design-tools"]], "Laser design": [[31, "laser-design"]], "Laser-Masking": [[34, "laser-masking"]], "Masking": [[31, "masking"]], "Modules under LITESOPH": [[8, "modules-under-litesoph"], [9, "modules-under-litesoph"]], "Modules, Functions and Working": [[10, "modules-functions-and-working"], [12, "modules-functions-and-working"]], "Molecular Orbital (MO) Population": [[21, "molecular-orbital-mo-population"], [35, "molecular-orbital-mo-population"]], "Multiplicity": [[43, "multiplicity"]], "NWchem": [[40, "nwchem"]], "New Workflow": [[44, "new-workflow"]], "Normal Mode analysis (upcoming)": [[19, "normal-mode-analysis-upcoming"]], "Octopus": [[40, "octopus"]], "Overview": [[45, "overview"]], "Parameters": [[9, "parameters"], [43, "parameters"]], "Past contributors": [[41, "past-contributors"]], "Population Evolution": [[17, "population-evolution"]], "Post processing and visualization": [[30, "post-processing-and-visualization"]], "Properties": [[31, "properties"]], "Pump-probe": [[36, "pump-probe"]], "Python": [[40, "id1"]], "Python venv environment": [[6, "python-venv-environment"]], "RT-TDDFT": [[31, "rt-tddft"]], "RT-TDDFT with QM/MM method (upcoming)": [[20, "rt-tddft-with-qm-mm-method-upcoming"]], "References": [[21, "references"]], "Release Notes": [[42, "release-notes"]], "Relevant Methods": [[8, "relevant-methods"]], "Remarks": [[8, "remarks"]], "Results for Na8 Chain using GUI for GPAW Engine": [[17, "results-for-na8-chain-using-gui-for-gpaw-engine"]], "Setting up your development environment": [[6, "setting-up-your-development-environment"]], "Setting up your local repository": [[6, "setting-up-your-local-repository"]], "Simulations of Photo-Induced Properties using LITESOPH": [[21, "simulations-of-photo-induced-properties-using-litesoph"]], "Spectrum": [[37, "spectrum"]], "Spectrum Analysis": [[14, "spectrum-analysis"], [15, "spectrum-analysis"], [17, "spectrum-analysis"]], "Starting LITESOPH": [[44, "starting-litesoph"]], "TDDFT calculations using GPAW": [[17, "tddft-calculations-using-gpaw"]], "TDDFT calculations using 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