{"type":"doc","content":[{"type":"paragraph","content":[{"text":"PWgui is a GUI for PWscf based programs from ","type":"text"},{"text":"Quantum-ESPRESSO","type":"text","marks":[{"type":"link","attrs":{"href":"https://lehigh.atlassian.net/wiki/spaces/hpc/pages/45252697"}}]},{"text":" integrated suite of codes for electronic structure calculations and materials modeling at the nanoscale.","type":"text"}]},{"type":"heading","attrs":{"level":3},"content":[{"text":"Usage","type":"text"}]},{"type":"table","attrs":{"layout":"align-start"},"content":[{"type":"tableRow","content":[{"type":"tableHeader","attrs":{"colspan":1,"rowspan":1},"content":[{"type":"paragraph","content":[{"text":"Version","type":"text","marks":[{"type":"strong"}]}]}]},{"type":"tableHeader","attrs":{"colspan":1,"rowspan":1},"content":[{"type":"paragraph","content":[{"text":"module","type":"text","marks":[{"type":"strong"}]}]}]}]},{"type":"tableRow","content":[{"type":"tableCell","attrs":{"colspan":1,"rowspan":1},"content":[{"type":"paragraph"}]},{"type":"tableCell","attrs":{"colspan":1,"rowspan":1},"content":[{"type":"paragraph"}]}]}]},{"type":"paragraph"},{"type":"heading","attrs":{"level":3},"content":[{"text":"Open OnDemand","type":"text"}]},{"type":"expand","attrs":{"title":"Select Visualization from the Interactive Apps dropdown."},"content":[{"type":"mediaSingle","attrs":{"layout":"align-start","width":659,"widthType":"pixel"},"content":[{"type":"media","attrs":{"width":1280,"id":"8b426a4a-0e39-4690-9fbf-2eb50ec262f7","collection":"contentId-45252690","type":"file","height":776}}]}]},{"type":"expand","attrs":{"title":"Select PWGui from the dropdown list and choose the resources you want to use. Click \"Launch\" to submit your request to the SLURM scheduler."},"content":[{"type":"mediaSingle","attrs":{"layout":"align-start","width":696,"widthType":"pixel"},"content":[{"type":"media","attrs":{"width":1280,"id":"68ecab9a-a948-4ec4-97ef-a03e594ac5af","collection":"contentId-45252690","type":"file","height":735}}]}]},{"type":"expand","attrs":{"title":"When resources are available, a blue \"Launch Visualization\" button will appear. Click the button to launch PWGui."},"content":[{"type":"mediaSingle","attrs":{"layout":"align-start","width":659,"widthType":"pixel"},"content":[{"type":"media","attrs":{"width":1280,"id":"f0cfce80-9247-4e81-907f-92bf1df332d0","collection":"contentId-45252701","type":"file","height":776}}]}]},{"type":"expand","attrs":{"title":"PWGui on Open OnDemand"},"content":[{"type":"mediaSingle","attrs":{"layout":"align-start","width":659,"widthType":"pixel"},"content":[{"type":"media","attrs":{"width":1280,"id":"b3d9d4b7-9109-4ab1-8ac8-eaa5530ba3d7","collection":"contentId-45252701","type":"file","height":776}}]}]},{"type":"expand","attrs":{"title":"Demo"},"content":[{"type":"extension","attrs":{"extensionType":"com.atlassian.confluence.migration","extensionKey":"legacy-content","text":"","parameters":{"nestedContent":{"type":"doc","content":[{"type":"bodiedExtension","attrs":{"extensionType":"com.atlassian.confluence.macro.core","extensionKey":"section","parameters":{"macroParams":{},"macroMetadata":{"macroId":{"value":"b6bb1a46-3ce4-4f93-ab41-4aafcd620571"},"schemaVersion":{"value":"1"},"title":"Section"}}},"content":[{"type":"extension","attrs":{"extensionType":"com.atlassian.confluence.macro.core","extensionKey":"html","parameters":{"macroParams":{"__bodyContent":{"value":"

"}},"macroMetadata":{"macroId":{"value":"13f13ed5-af51-4ba7-9063-dbb65b9af0c0"},"schemaVersion":{"value":"1"},"title":"html"}}}}]}],"version":1},"cxhtml":"

]]>

"}}}]},{"type":"heading","attrs":{"level":3},"content":[{"text":"Useful Links","type":"text"}]},{"type":"bulletList","content":[{"type":"listItem","content":[{"type":"paragraph","content":[{"text":"http://www-k3.ijs.si/kokalj/pwgui/","type":"text","marks":[{"type":"link","attrs":{"href":"http://www-k3.ijs.si/kokalj/pwgui/"}}]}]}]}]},{"type":"paragraph"},{"type":"paragraph"},{"type":"mediaSingle","attrs":{"layout":"align-start","width":32,"widthType":"pixel"},"content":[{"type":"media","attrs":{"type":"external","url":"https://cdn.rawgit.com/spack/spack/develop/share/spack/logo/spack-logo.svg"}}]}],"version":1}