Effect of Salt Concentration on Ion Clustering and Transport in Polymer Solid Electrolytes: A Molecular Dynamics Study of PEO–LiTFSI von Molinari, Nicola, Mailoa, Jonathan P, Kozinsky, Boris

Volltext

E(3)-equivariant graph neural networks for data-efficient and accurate interatomic potentials von Batzner, Simon, Musaelian, Albert, Sun, Lixin, Geiger, Mario, Mailoa, Jonathan P., Kornbluth, Mordechai, Molinari, Nicola, Smidt, Tess E., Kozinsky, Boris

Volltext

General Trend of a Negative Li Effective Charge in Ionic Liquid Electrolytes von Molinari, Nicola, Mailoa, Jonathan P, Kozinsky, Boris

Volltext

Transport anomalies emerging from strong correlation in ionic liquid electrolytes von Molinari, Nicola, Mailoa, Jonathan P., Craig, Nathan, Christensen, Jake, Kozinsky, Boris

Volltext

3T-VASP: fast ab-initio electrochemical reactor via multi-scale gradient energy minimization von Mailoa, Jonathan P., Li, Xin, Zhang, Shengyu

Volltext

A 2-terminal perovskite/silicon multijunction solar cell enabled by a silicon tunnel junction von Mailoa, Jonathan P., Bailie, Colin D., Johlin, Eric C., Hoke, Eric T., Akey, Austin J., Nguyen, William H., McGehee, Michael D., Buonassisi, Tonio

Volltext

Atomic Layer Deposited Gallium Oxide Buffer Layer Enables 1.2 V Open-Circuit Voltage in Cuprous Oxide Solar Cells von Lee, Yun Seog, Chua, Danny, Brandt, Riley E., Siah, Sin Cheng, Li, Jian V., Mailoa, Jonathan P., Lee, Sang Woon, Gordon, Roy G., Buonassisi, Tonio

Volltext

Accurate and scalable graph neural network force field and molecular dynamics with direct force architecture von Park, Cheol Woo, Kornbluth, Mordechai, Vandermause, Jonathan, Wolverton, Chris, Kozinsky, Boris, Mailoa, Jonathan P.

Volltext

Ultrathin amorphous zinc-tin-oxide buffer layer for enhancing heterojunction interface quality in metal-oxide solar cells von Lee, Yun Seog, Heo, Jaeyeong, Siah, Sin Cheng, Mailoa, Jonathan P, Brandt, Riley E, Kim, Sang Bok, Gordon, Roy G, Buonassisi, Tonio

Volltext

Improved Cu2O-Based Solar Cells Using Atomic Layer Deposition to Control the Cu Oxidation State at the p-n Junction von Lee, Sang Woon, Lee, Yun Seog, Heo, Jaeyeong, Siah, Sin Cheng, Chua, Danny, Brandt, Riley E., Kim, Sang Bok, Mailoa, Jonathan P., Buonassisi, Tonio, Gordon, Roy G.

Volltext

Room-temperature sub-band gap optoelectronic response of hyperdoped silicon von Mailoa, Jonathan P., Akey, Austin J., Simmons, Christie B., Hutchinson, David, Mathews, Jay, Sullivan, Joseph T., Recht, Daniel, Winkler, Mark T., Williams, James S., Warrender, Jeffrey M., Persans, Peter D., Aziz, Michael J., Buonassisi, Tonio

Volltext

Role of solvent-anion charge transfer in oxidative degradation of battery electrolytes von Fadel, Eric R., Faglioni, Francesco, Samsonidze, Georgy, Molinari, Nicola, Merinov, Boris V., Goddard III, William A., Grossman, Jeffrey C., Mailoa, Jonathan P., Kozinsky, Boris

Volltext

Relationship between Segmental Dynamics Measured by Quasi-Elastic Neutron Scattering and Conductivity in Polymer Electrolytes von Mongcopa, Katrina Irene S, Tyagi, Madhusudan, Mailoa, Jonathan P, Samsonidze, Georgy, Kozinsky, Boris, Mullin, Scott A, Gribble, Daniel A, Watanabe, Hiroshi, Balsara, Nitash P

Volltext

Enhancing the Infrared Photoresponse of Silicon by Controlling the Fermi Level Location within an Impurity Band von Simmons, Christie B., Akey, Austin J., Mailoa, Jonathan P., Recht, Daniel, Aziz, Michael J., Buonassisi, Tonio

Volltext

A community-powered search of machine learning strategy space to find NMR property prediction models von Bratholm, Lars A, Gerrard, Will, Anderson, Brandon, Bai, Shaojie, Choi, Sunghwan, Dang, Lam, Hanchar, Pavel, Howard, Addison, Kim, Sanghoon, Kolter, Zico, Kondor, Risi, Kornbluth, Mordechai, Lee, Youhan, Lee, Youngsoo, Mailoa, Jonathan P, Nguyen, Thanh Tu, Popovic, Milos, Rakocevic, Goran, Reade, Walter, Song, Wonho, Stojanovic, Luka, Thiede, Erik H, Tijanic, Nebojsa, Torrubia, Andres, Willmott, Devin, Butts, Craig P, Glowacki, David R

Volltext

Economic viability of thin-film tandem solar modules in the United States von Sofia, Sarah E., Mailoa, Jonathan P., Weiss, Dirk N., Stanbery, Billy J., Buonassisi, Tonio, Peters, I. Marius

Volltext

Semi-transparent perovskite solar cells for tandems with silicon and CIGS von Bailie, Colin D, Christoforo, MGreyson, Mailoa, Jonathan P, Bowring, Andrea R, Unger, Eva L, Nguyen, William H, Burschka, Julian, Pellet, Norman, Lee, Jungwoo Z, Graetzel, Michael, Noufi, Rommel, Buonassisi, Tonio, Salleo, Alberto, McGehee, Michael D

Volltext

TenCirChem: An Efficient Quantum Computational Chemistry Package for the NISQ Era von Li, Weitang, Allcock, Jonathan, Cheng, Lixue, Zhang, Shi-Xin, Chen, Yu-Qin, Mailoa, Jonathan P., Shuai, Zhigang, Zhang, Shengyu

Volltext

23.6%-efficient monolithic perovskite/silicon tandem solar cells with improved stability von Bush, Kevin A., Palmstrom, Axel F., Yu, Zhengshan J., Boccard, Mathieu, Cheacharoen, Rongrong, Mailoa, Jonathan P., McMeekin, David P., Hoye, Robert L. Z., Bailie, Colin D., Leijtens, Tomas, Peters, Ian Marius, Minichetti, Maxmillian C., Rolston, Nicholas, Prasanna, Rohit, Sofia, Sarah, Harwood, Duncan, Ma, Wen, Moghadam, Farhad, Snaith, Henry J., Buonassisi, Tonio, Holman, Zachary C., Bent, Stacey F., McGehee, Michael D.

Volltext

Controlled Water Uptake in Fuel Cell Membranes with Dual Chemistry Confinement von Huang, Hejin, Cao, Zhen, Gadelrab, Karim R, Mailoa, Jonathan P, Alexander-Katz, Alfredo

Volltext