المؤلفون: Hunter, Kye E., Mao, Yuezhi, Chin, Alex W., Zuehlsdorff, Tim J.

مصطلحات موضوعية: Physics - Chemical Physics

الوصول الحر: http://arxiv.org/abs/2403.03316Test

المؤلفون: Chen, Michael S., Mao, Yuezhi, Snider, Andrew, Gupta, Prachi, Montoya-Castillo, Andrés, Zuehlsdorff, Tim J., Isborn, Christine M., Markland, Thomas E.

مصطلحات موضوعية: Physics - Chemical Physics, Condensed Matter - Disordered Systems and Neural Networks

الوصول الحر: http://arxiv.org/abs/2305.16981Test

المؤلفون: Aldossary, Abdulrahman, Gimferrer, Martí, Mao, Yuezhi, Hao, Hongxia, Das, Akshaya K, Salvador, Pedro, Head-Gordon, Teresa, Head-Gordon, Martin

المصدر: The Journal of Physical Chemistry A. 127(7)

مصطلحات موضوعية: Atomic, Molecular, Nuclear, Particle and Plasma Physics, Physical Chemistry (incl. Structural), Theoretical and Computational Chemistry

وصف الملف: application/pdf

الوصول الحر: https://escholarship.org/uc/item/68355106Test

المؤلفون: Eastman, Peter, Behara, Pavan Kumar, Dotson, David L., Galvelis, Raimondas, Herr, John E., Horton, Josh T., Mao, Yuezhi, Chodera, John D., Pritchard, Benjamin P., Wang, Yuanqing, De Fabritiis, Gianni, Markland, Thomas E.

مصطلحات موضوعية: Physics - Chemical Physics, Computer Science - Machine Learning, Quantitative Biology - Biomolecules

الوصول الحر: http://arxiv.org/abs/2209.10702Test

المؤلفون: Cunha, Leonardo A., Hait, Diptarka, Kang, Richard, Mao, Yuezhi, Head-Gordon, Martin

المصدر: J. Phys. Chem. Lett. 2022, 13, 3438-3449

مصطلحات موضوعية: Physics - Chemical Physics, Condensed Matter - Other Condensed Matter, Physics - Atomic and Molecular Clusters, Quantum Physics

الوصول الحر: http://arxiv.org/abs/2111.08405Test

المؤلفون: Cunha, Leonardo A, Hait, Diptarka, Kang, Richard, Mao, Yuezhi, Head-Gordon, Martin

المصدر: The Journal of Physical Chemistry Letters. 13(15)

مصطلحات موضوعية: Physical Sciences, Chemical Sciences

وصف الملف: application/pdf

الوصول الحر: https://escholarship.org/uc/item/4nq9086gTest

المؤلفون: Epifanovsky, Evgeny, Gilbert, Andrew TB, Feng, Xintian, Lee, Joonho, Mao, Yuezhi, Mardirossian, Narbe, Pokhilko, Pavel, White, Alec F, Coons, Marc P, Dempwolff, Adrian L, Gan, Zhengting, Hait, Diptarka, Horn, Paul R, Jacobson, Leif D, Kaliman, Ilya, Kussmann, Jörg, Lange, Adrian W, Lao, Ka Un, Levine, Daniel S, Liu, Jie, McKenzie, Simon C, Morrison, Adrian F, Nanda, Kaushik D, Plasser, Felix, Rehn, Dirk R, Vidal, Marta L, You, Zhi-Qiang, Zhu, Ying, Alam, Bushra, Albrecht, Benjamin J, Aldossary, Abdulrahman, Alguire, Ethan, Andersen, Josefine H, Athavale, Vishikh, Barton, Dennis, Begam, Khadiza, Behn, Andrew, Bellonzi, Nicole, Bernard, Yves A, Berquist, Eric J, Burton, Hugh GA, Carreras, Abel, Carter-Fenk, Kevin, Chakraborty, Romit, Chien, Alan D, Closser, Kristina D, Cofer-Shabica, Vale, Dasgupta, Saswata, de Wergifosse, Marc, Deng, Jia, Diedenhofen, Michael, Do, Hainam, Ehlert, Sebastian, Fang, Po-Tung, Fatehi, Shervin, Feng, Qingguo, Friedhoff, Triet, Gayvert, James, Ge, Qinghui, Gidofalvi, Gergely, Goldey, Matthew, Gomes, Joe, González-Espinoza, Cristina E, Gulania, Sahil, Gunina, Anastasia O, Hanson-Heine, Magnus WD, Harbach, Phillip HP, Hauser, Andreas, Herbst, Michael F, Vera, Mario Hernández, Hodecker, Manuel, Holden, Zachary C, Houck, Shannon, Huang, Xunkun, Hui, Kerwin, Huynh, Bang C, Ivanov, Maxim, Jász, Ádám, Ji, Hyunjun, Jiang, Hanjie, Kaduk, Benjamin, Kähler, Sven, Khistyaev, Kirill, Kim, Jaehoon, Kis, Gergely, Klunzinger, Phil, Koczor-Benda, Zsuzsanna, Koh, Joong Hoon, Kosenkov, Dimitri, Koulias, Laura, Kowalczyk, Tim, Krauter, Caroline M, Kue, Karl, Kunitsa, Alexander, Kus, Thomas, Ladjánszki, István, Landau, Arie, Lawler, Keith V, Lefrancois, Daniel, Lehtola, Susi

المصدر: The Journal of Chemical Physics. 155(8)

مصطلحات موضوعية: Physical Sciences, Chemical Sciences, Atomic, Molecular and Optical Physics, Physical Chemistry, Engineering, Chemical Physics, Chemical sciences, Physical sciences

وصف الملف: application/pdf

الوصول الحر: https://escholarship.org/uc/item/8104w62bTest
https://escholarship.org/content/qt8104w62b/qt8104w62b.pdfTest

المؤلفون: Veccham, Srimukh Prasad, Lee, Joonho, Mao, Yuezhi, Horn, Paul R., Head-Gordon, Martin

المصدر: Phys. Chem. Chem. Phys., 2021, 23, 928-943

مصطلحات موضوعية: Physics - Chemical Physics

الوصول الحر: http://arxiv.org/abs/2011.04918Test

المؤلفون: Mao, Yuezhi, Montoya-Castillo, Andres, Markland, Thomas E.

مصطلحات موضوعية: Physics - Chemical Physics

الوصول الحر: http://arxiv.org/abs/2011.04847Test

المؤلفون: Mao, Yuezhi, Loipersberger, Matthias, Horn, Paul R, Das, Akshaya, Demerdash, Omar, Levine, Daniel S, Prasad Veccham, Srimukh, Head-Gordon, Teresa, Head-Gordon, Martin

المصدر: Annual Review of Physical Chemistry. 72(1)

مصطلحات موضوعية: Inorganic Chemistry, Chemical Sciences, Physical Chemistry, Theoretical and Computational Chemistry, density functional theory, energy decomposition analysis, intermolecular interactions, hydrogen bonding, dative bonds, radical-molecule complex, force fields, radical–molecule complex, Physical Chemistry (incl. Structural), Chemical Physics, Physical chemistry, Theoretical and computational chemistry

وصف الملف: application/pdf

الوصول الحر: https://escholarship.org/uc/item/8mg429w9Test