Antisymmetry: Fundamentals and Applications von Padmanabhan, Hari, Munro, Jason M, Dabo, Ismaila, Gopalan, Venkatraman

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Predicting and Accelerating Nanomaterial Synthesis Using Machine Learning Featurization von Price, Christopher C., Li, Yansong, Zhou, Guanyu, Younas, Rehan, Zeng, Spencer S., Scanlon, Tim H., Munro, Jason M., Hinkle, Christopher L.

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Triplet Transfer Mediates Triplet Pair Separation during Singlet Fission in 6,13‐Bis(triisopropylsilylethynyl)‐Pentacene von Grieco, Christopher, Doucette, Grayson S., Munro, Jason M., Kennehan, Eric R., Lee, Youngmin, Rimshaw, Adam, Payne, Marcia M., Wonderling, Nichole, Anthony, John E., Dabo, Ismaila, Gomez, Enrique D., Asbury, John B.

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High-throughput search for magnetic and topological order in transition metal oxides von Frey, Nathan C, Horton, Matthew K, Munro, Jason M, Griffin, Sinéad M, Persson, Kristin A, Shenoy, Vivek B

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An improved symmetry-based approach to reciprocal space path selection in band structure calculations von Munro, Jason M., Latimer, Katherine, Horton, Matthew K., Dwaraknath, Shyam, Persson, Kristin A.

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A flexible and scalable scheme for mixing computed formation energies from different levels of theory von Kingsbury, Ryan S., Rosen, Andrew S., Gupta, Ayush S., Munro, Jason M., Ong, Shyue Ping, Jain, Anubhav, Dwaraknath, Shyam, Horton, Matthew K., Persson, Kristin A.

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Vibrational probe of the origin of singlet exciton fission in TIPS-pentacene solutions von Grieco, Christopher, Doucette, Grayson S., Munson, Kyle T., Swartzfager, John R., Munro, Jason M., Anthony, John E., Dabo, Ismaila, Asbury, John B.

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A representation-independent electronic charge density database for crystalline materials von Shen, Jimmy-Xuan, Munro, Jason M., Horton, Matthew K., Huck, Patrick, Dwaraknath, Shyam, Persson, Kristin A.

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An equivariant graph neural network for the elasticity tensors of all seven crystal systems von Wen, Mingjian, Horton, Matthew K, Munro, Jason M, Huck, Patrick, Persson, Kristin A

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Conjugated Block Copolymers as Model Systems to Examine Mechanisms of Charge Generation in Donor–Acceptor Materials von Aplan, Melissa P., Grieco, Christopher, Lee, Youngmin, Munro, Jason M., Lee, Wonho, Gray, Jennifer L., Seibers, Zach D., Kuei, Brooke, Litofsky, Joshua H., Kilbey, S. Michael, Wang, Qing, Dabo, Ismaila, Asbury, John B., Gomez, Enrique D.

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Spatio-Temporal Symmetry—Point Groups with Time Translations von Padmanabhan, Haricharan, Kingsland, Maggie, Munro, Jason, Litvin, Daniel, Gopalan, Venkatraman

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Revealing the Importance of Energetic and Entropic Contributions to the Driving Force for Charge Photogeneration von Aplan, Melissa P, Munro, Jason M, Lee, Youngmin, Brigeman, Alyssa N, Grieco, Christopher, Wang, Qing, Giebink, Noel C, Dabo, Ismaila, Asbury, John B, Gomez, Enrique D

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A database of molecular properties integrated in the Materials Project von Spotte-Smith, Evan Walter Clark, Cohen, Orion Archer, Blau, Samuel M, Munro, Jason M, Yang, Ruoxi, Guha, Rishabh D, Patel, Hetal D, Vijay, Sudarshan, Huck, Patrick, Kingsbury, Ryan, Horton, Matthew K, Persson, Kristin A

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Spatio‐temporal symmetry – crystallographic point groups with time translations and time inversion von Liu, Vincent S., VanLeeuwen, Brian K., Munro, Jason M., Padmanabhan, Haricharan, Dabo, Ismaila, Gopalan, Venkatraman, Litvin, Daniel B.

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Implementation of distortion symmetry for the nudged elastic band method with DiSPy von Munro, Jason M., Liu, Vincent S., Gopalan, Venkatraman, Dabo, Ismaila

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Discovering minimum energy pathways via distortion symmetry groups von Munro, Jason M, Akamatsu, Hirofumi, Padmanabhan, Haricharan, Liu, Vincent S, Shi, Yin, Chen, Long-Qing, VanLeeuwen, Brian K, Dabo, Ismaila, Gopalan, Venkatraman

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Tuning Triplet-Pair Separation versus Relaxation Using a Diamond Anvil Cell von Doucette, Grayson S., Huang, Haw-Tyng, Munro, Jason M., Munson, Kyle T., Park, Changyong, Anthony, John E., Strobel, Timothy, Dabo, Ismaila, Badding, John V., Asbury, John B.

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How to analyse a density of states von Toriyama, Michael Y., Ganose, Alex M., Dylla, Maxwell, Anand, Shashwat, Park, Junsoo, Brod, Madison K., Munro, Jason M., Persson, Kristin A., Jain, Anubhav, Snyder, G. Jeffrey

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Understanding the influence of defects and surface chemistry on ferroelectric switching: a ReaxFF investigation of BaTiO3 von Akbarian, Dooman, Yilmaz, Dundar E, Cao, Ye, Ganesh, P, Dabo, Ismaila, Munro, Jason, Renee Van Ginhoven, Adri C T van Duin

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Vibrational probe of the origin of singlet exciton fission in TIPS-pentacene solutions von Grieco, Christopher, Doucette, Grayson S., Munson, Kyle T., Swartzfager, John R., Munro, Jason M., Anthony, John E., Dabo, Ismaila, Asbury, John B.

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