4,111 research outputs found

    Data for "Robust, accurate, and efficient: quantum embedding using the Huzinaga level-shift projection operator for complex systems"

    No full text
    Geometry files are stored in xyz format. Geometries are optimized using the method defined within the accompanying text. QSoME output files are stored as out files and readable in ascii text format. Relevant molpro orbital files are stored in molden format.All output and relevant molden orbital files for ground state Huzinaga embedding WF-in-DFT energy calculations.DE-FG02-17ER16362MSINMGCNERSCDE-AC02-05CH11231Graham, Daniel; Wen, Xuelan; Chulhai, Dhabih; Goodpaster, Jason. (2019). Data for "Robust, accurate, and efficient: quantum embedding using the Huzinaga level-shift projection operator for complex systems". Retrieved from the University Digital Conservancy, https://doi.org/10.13020/r7c0-2x97

    Data for Huzinaga Projection Embedding for Efficient and Accurate Energies of Systems with Localized Spin-densities

    No full text
    Geometry files are stored in xyz format. Geometries are optimized using the method defined within the accompanying text. QSoME output files are stored as out files and readable in ascii text format.All relevant output files for open-shell ground state Huzinaga embedding WF-in-DFT energy calculations.DE-FG02-17ER16362DE-AC02-05CH11231MSINMGCGraham, Daniel S; Wen, Xuelan; Chulhai, Dhabih V; Goodpaster, Jason D. (2021). Data for Huzinaga Projection Embedding for Efficient and Accurate Energies of Systems with Localized Spin-densities. Retrieved from the University Digital Conservancy, https://doi.org/10.13020/3dwv-wv71

    Geometries for Improving and Understanding the Hydrogen Evolving Activity of a Cobalt Dithiolene Metal-Organic Framework

    No full text
    Geometry files are stored in xyz format. Geometries are optimized using the method defined within the manuscriptAll geometries for DFT calculations performed in the study of CoTHT.Sponsorship: DE-FG02-17ER16362; MSI; NMGC; NERSC; DE-AC02-05CH11231Goodpaster, Jason D; Chen, Keying; Downes, Courtney; Eugene, Schneider; Marinescu, Smaranda. (2020). Geometries for Improving and Understanding the Hydrogen Evolving Activity of a Cobalt Dithiolene Metal-Organic Framework. Retrieved from the University Digital Conservancy, https://hdl.handle.net/11299/211666

    Elucidating the role of enzyme environment and point mutations on the catalytic activity of FeNi Hydrogenase

    No full text
    Faculty Advisor: Jason GoodpasterThis research was supported by the Undergraduate Research Opportunities Program (UROP).Tews, Austin; McGreal, Meghan E.; Goodpaster, Jason D.. (2019). Elucidating the role of enzyme environment and point mutations on the catalytic activity of FeNi Hydrogenase. Retrieved from the University Digital Conservancy, https://hdl.handle.net/11299/203009

    Jason Bond Family History

    No full text
    Jason Bond authored this family history as part of the course requirements for HIST 550/700 Your Family in History offered online in Fall 2017 and was submitted to the Pittsburg State University Digital Commons. Please contact the author directly with any questions or comments: [email protected]

    Jason vs GIJOE

    No full text
    Thesis (Master's)--University of Washington, 2019Jason vs GI JOE is partly an exercise in autobiography, an experiment in relational aesthetics, and an interdisciplinary artist project at the intersection of comic books, creative writing and performance art. This comic book, Jason vs. GIJOE, is a postmodern double erasure, based on the comic book GIJOE: Cobra II (Issue 1). The original pictures from the comic book have been removed, and replaced by a series of short narratives, describing autobiographical events from the life of the author: me, Jason. Speech bubbles from the original have been left to comment back over top of the stories, obscuring meaning but creating moments of unplanned dialogue. The comic is a readymade, twice erased: once to replace the drawings of the initial comic, and again when using the original dialogue bubbles to speak back to the narrative

    Oral history interview with Jason Poudrier

    No full text
    Jason Poudrier, author, discusses growing up in a military family and living in Alaska, North Dakota, Oregon, and finally Oklahoma. He describes what it was like enlisting in the Army after high school in 2001 and how his military service affected him. A recipient of the Purple Heart, he shares his experiences getting injured by shrapnel in Iraq. He later talks about how he uses poetry and writing to cope with his memories of war, and how he hopes to help others do the same.The Deep Roots: Oklahoma Authors Collection is a series of interviews with authors who discuss their lives, work, and creative processes

    Lynn Brunelle and Jason Chin: Cook Prize 2025, Gold Medal Acceptance Speech

    No full text
    Author Lynn Brunelle and illustrator Jason Chin give an acceptance speech for Life After Whale: The Amazing Ecosystem of a Whale Fall (Neal Porter Books/Holiday House)https://educate.bankstreet.edu/cook/1016/thumbnail.jp

    The people behind the papers – Jason Ko and Daniel Lobo

    No full text
    Planarians grow when they are fed and shrink during periods of starvation. However, it is unclear how they maintain appropriate body proportions as their size changes. A new paper in Development investigates the differences between growth and shrinkage dynamics and builds a mathematical model to explore the mechanisms underpinning these two processes. To learn more about the story behind the paper, we caught up with first author, Jason Ko, and corresponding author, Daniel Lobo, Associate Professor at the University of Maryland.https://doi.org/10.1242/dev.20298

    Ep. #085 - Jason W. Moore

    No full text
    This recording and transcript form part of a collection of podcasts conducted by the Cultures of Energy at Rice University. Cultures of Energy brings writers, artists and scholars together to talk, think and feel their way into the Anthropocene. We cover serious issues like climate change, species extinction and energy transition. But we also try to confront seemingly huge and insurmountable problems with insight, creativity and laughter.Cymene and Dominic talk capital and Vanilla Isis and then (11:21) we welcome to the podcast the one and only Jason W. Moore from Binghamton University, author of Capitalism in the Web of Life (Verso, 2015) and Anthropocene or Capitalocene? (PM Press, 2016). We chat with Jason about his most recent work, co-authored with Raj Patel, A History of the World in Seven Cheap Things (U California Press, 2017), forthcoming this October. We talk about why he wanted to write a book for a broader audience, the problems with the “anthropocene” concept in the human sciences, how “capitalocene” can improve our thinking about world history, and how we can avoid vulgar materialism in critical environmental research and activism today. We cover the role that states and agriculture have played in shaping modern capitalism and Jason calls for a seriously engaged pluralism to tackle the urgent challenges of our era. We discuss the cheapening or thingification of life, capitalism as a gravitational field, the importance of frontiers, the violence of the Great Domestication, and why if green energy remains in the mode of “cheap fuel” nothing will change about capitalist accumulation. Jason explains why racial and gender domination are so often lacunae in critiques of petromodernity. Finally we ruminate on how to unmake the capitalist world-ecology and the key principles of the “reparation ecology” that Jason and his colleagues are calling for. Tired of the debate within the left about whether to prioritize jobs or the environment? Then you’ll want to listen on
    corecore