{"627066":{"#nid":"627066","#data":{"type":"event","title":"Psi4 Workshop","body":[{"value":"\u003Cp\u003EQuantum-chemical computations are an increasingly important component of modern chemical research. Psi4 is a freely-available, open-source program providing many popular electronic structure methods, including those based upon density functional theory, many-body perturbation theory, coupled-cluster theory, and configuration interaction. It has been designed to be as user-friendly as possible, both for beginning computational chemists and for advanced users. For users who want to automate complex workflows, Psi4 can now be called from a Python script as a regular Python module. This workshop will introduce the Psi4 program and how it can be used in research or education. Registration for Psi4 workshop is required and FREE.\u003C\/p\u003E\r\n\r\n\u003Cp\u003ETo register, visit \u003Ca href=\u0022https:\/\/www.eventbrite.com\/e\/psi4-workshop-tickets-74347733071\u0022\u003Ehttps:\/\/www.eventbrite.com\/e\/psi4-workshop-tickets-74347733071\u003C\/a\u003E.\u003C\/p\u003E\r\n\r\n\u003Cp\u003E\u003Cstrong\u003EHosted by PACE and Presented by Prof. David Sherrill and team.\u003C\/strong\u003E\u003C\/p\u003E\r\n\r\n\u003Cp\u003E\u0026nbsp;\u003C\/p\u003E\r\n","summary":null,"format":"limited_html"}],"field_subtitle":"","field_summary":[{"value":"\u003Cp\u003EQuantum-chemical computations are an increasingly important component of modern chemical research. Psi4 is a freely-available, open-source program providing many popular electronic structure methods, including those based upon density functional theory, many-body perturbation theory, coupled-cluster theory, and configuration interaction. It has been designed to be as user-friendly as possible, both for beginning computational chemists and for advanced users. For users who want to automate complex workflows, Psi4 can now be called from a Python script as a regular Python module. This workshop will introduce the Psi4 program and how it can be used in research or education. Registration for Psi4 workshop is required and FREE.\u003C\/p\u003E\r\n\r\n\u003Cp\u003ETo register, visit \u003Ca href=\u0022https:\/\/www.eventbrite.com\/e\/psi4-workshop-tickets-74347733071\u0022\u003Ehttps:\/\/www.eventbrite.com\/e\/psi4-workshop-tickets-74347733071\u003C\/a\u003E.\u003C\/p\u003E\r\n\r\n\u003Cp\u003E\u003Cstrong\u003EHosted by PACE and Presented by Prof. David Sherrill and team.\u003C\/strong\u003E\u003C\/p\u003E\r\n\r\n\u003Cp\u003E\u0026nbsp;\u003C\/p\u003E\r\n","format":"limited_html"}],"field_summary_sentence":[{"value":"PACE invites you to attend a workshop on Psi4 software taught by its author, Prof. David Sherrill. "}],"uid":"35120","created_gmt":"2019-10-02 21:39:46","changed_gmt":"2019-10-02 21:40:53","author":"mweiner3","boilerplate_text":"","field_publication":"","field_article_url":"","field_event_time":{"event_time_start":"2019-10-16T15:00:00-04:00","event_time_end":"2019-10-16T17:00:00-04:00","event_time_end_last":"2019-10-16T17:00:00-04:00","gmt_time_start":"2019-10-16 19:00:00","gmt_time_end":"2019-10-16 21:00:00","gmt_time_end_last":"2019-10-16 21:00:00","rrule":null,"timezone":"America\/New_York"},"extras":[],"groups":[{"id":"337231","name":"Georgia Tech High Performance Computing (PACE)"}],"categories":[],"keywords":[{"id":"168596","name":"PACE"}],"core_research_areas":[],"news_room_topics":[],"event_categories":[{"id":"26411","name":"Training\/Workshop"}],"invited_audience":[{"id":"78761","name":"Faculty\/Staff"},{"id":"177814","name":"Postdoc"},{"id":"78771","name":"Public"},{"id":"174045","name":"Graduate students"},{"id":"78751","name":"Undergraduate students"}],"affiliations":[],"classification":[],"areas_of_expertise":[],"news_and_recent_appearances":[],"phone":[],"contact":[{"value":"\u003Cp\u003EMichael Weiner,\u003C\/p\u003E\r\n\r\n\u003Cp\u003Emweiner3@gatech.edu\u003C\/p\u003E\r\n","format":"limited_html"}],"email":[],"slides":[],"orientation":[],"userdata":""}}}