Environmentally friendly synthesis and morphology engineering of mixed-metal MOF for outstanding CO2 capture efficiency

Authors: Kazemi, Amir ^{a, b}, Pordsari, Mahyar Ashourzadeh ^c, Tamtaji, Mohsen ^d, Manteghi, Faranak ^{a, ⁎}, Ghaemi, Ahad ^{c, ⁎}, Rohani, Sohrab ^b, Goddard, William A., III ^e

Source: In Chemical Engineering Journal 1 February 2025 505

Stable isotope equilibria in the dihydrogen-water-methane-ethane-propane system. Part 1: Path-integral calculations with CCSD(T) quality potentials

Authors: Korol, Roman ^{a, b, ⁎}, Turner, Andrew C. ^{c, d, e}, Nandi, Apurba ^{f, g}, Bowman, Joel M. ^f, Goddard, William A., III ^{a, h}, Stolper, Daniel A. ^{c, d}

Source: In Geochimica et Cosmochimica Acta February 2025

Energy dissipation mechanism of G-phase and L-phase metallic glass nanofilms subjected to high-velocity nano-ballistic impact

Authors: Cheng, Yujie ^{a, c}, Shen, Yidi ^b, An, Qi ^d, Jiang, Minqiang ^{c, e}, Huang, Chenguang ^c, Goddard, William A., III ^b, Wu, Xianqian ^{a, c, ⁎}

Source: In Extreme Mechanics Letters January 2025 74

Controlling the temperature build-up in electrode-sealed coin-shaped batteries via designing central heat dissipator

Authors: Aryanfar, Asghar, Elias, Fadi, Goddard, William A., III

Source: In Applied Thermal Engineering 1 November 2024 256

Unraveling the role of boron dimers in the electrical anisotropy and superconductivity in boron-doped diamond

Authors: Sobaszek, Michał, Kwon, Soonho, Klimczuk, Tomasz, Michałowski, Paweł P., Ryl, Jacek, Rutkowski, Bogdan, Wang, Dongying, Li, Xinwei, Bockrath, Marc, Bogdanowicz, Robert, Goddard, William A., III

Source: In Carbon September 2024 228

Unveiling the power of defect engineering in MOF-808 to enhance efficient carbon dioxide adsorption and separation by harnessing the potential of DFT analysis

Authors: Kazemi, Amir, Pordsari, Mahyar Ashourzadeh, Tamtaji, Mohsen, Afshari, Mohammad Hossein, Keshavarz, Saber, Zeinali, Fateme, Baesmat, Hasan, Zahiri, Shahla, Manteghi, Faranak, Ghaemi, Ahad, Rohani, Sohrab, Goddard, William A., III

Source: In Chemical Engineering Journal 15 August 2024 494

2D vs 3D clustering of the elliptic particulates: The correlation with the percolation thresholds

Authors: Aryanfar, Asghar ^{a, ⁎}, Yamani, Mahmoud ^b, Goddard, William A., III ^c

Source: In Applied Mathematical Modelling July 2025 143

A nanotwin-based physical model for designing robust layered bismuth telluride thermoelectric semiconductor

Authors: Huang, Xiege, Zhou, Xiong, Wu, Luoqi, Feng, Xiaobin, Zhai, Pengcheng, Duan, Bo, Li, Guodong, Zhang, Qingjie, Goddard, William A., III

Source: In Cell Reports Physical Science 20 March 2024 5(3)

Graphene-supported single atom catalysts for high performance lithium-oxygen batteries

Authors: Wong, Hoilun, Liu, Tongchao, Tamtaji, Mohsen, Huang, Xiaozhou, Tang, Tsz Wing, Hossain, Md Delowar, Wang, Jun, Cai, Yuting, Liu, Zhenjing, Liu, Hongwei, Amine, Khalil, Goddard, William A., III, Luo, Zhengtang

Source: In Nano Energy March 2024 121

Dual atom catalysts for rapid electrochemical reduction of CO to ethylene

Authors: Musgrave, Charles B., III, Li, Yuyin, Luo, Zhengtang, Goddard, William A., III

Source: In Nano Energy 15 December 2023 118 Part A

Genipin and pyrogallol: Two natural small molecules targeting the modulation of disordered proteins in Alzheimer's disease

Authors: Kim, Sujin, Hyun, Da Gyeong, Nam, Yunkwon, Shin, Soo Jung, Im, Dongjoon, Kim, Hyeon soo, Leem, Seol Hwa, Park, Hyun Ha, Kim, Byeong-Hyeon, Park, Yong Ho, Cho, Eunbi, Goddard, William A., III, Kim, Dong Hyun, Kim, Hugh I., Moon, Minho

Source: In Biomedicine & Pharmacotherapy December 2023 168

Proton transport through interfaces in nanophase-separation of hydrated aquivion membrane: Molecular dynamics simulation approach

Authors: Bazaid, Mohammed, Huang, Yu, Goddard, William A., III, Jang, Seung Soon

Source: In Colloids and Surfaces A: Physicochemical and Engineering Aspects 5 November 2023 676 Part A

Engineering twin boundaries for enhancing strength and ductility of thermoelectric semiconductor PbTe

Authors: Huang, Min, Zhai, Pengcheng, Morozov, Sergey I., Goddard, William A., III, Li, Guodong, Zhang, Qingjie

Source: In Journal of Alloys and Compounds 10 October 2023 959

Ru-loaded pyrrolic-N-doped extensively graphitized porous carbon for high performance electrochemical hydrogen evolution

Authors: Shin, Cheol-Hwan, Yu, Ted H., Lee, Ha-Young, Lee, Byeong-June, Kwon, Soonho, Goddard, William A., III, Yu, Jong-Sung

Source: In Applied Catalysis B: Environment and Energy 5 October 2023 334

Stacking fault-induced strengthening mechanism in thermoelectric semiconductor Bi2Te3

Authors: Huang, Xiege, Feng, Xiaobin, An, Qi, Huang, Ben, Zhang, Xiaolian, Lu, Zhongtao, Li, Guodong, Zhai, Pengcheng, Duan, Bo, Snyder, G. Jeffrey, Goddard, William A., III, Zhang, Qingjie

Source: In Matter 6 September 2023 6(9):3087-3098

Excellent impact resistance of multilayer metallic glass films subjected to micro-ballistic impact by overcoming dynamic size effects

Authors: Cheng, Yujie, Dong, Jinlei, Shen, Yidi, Li, Fucheng, An, Qi, Jiang, Minqiang, Liu, Yanhui, Huang, Chenguang, Goddard, William A., III, Wu, Xianqian

Source: In Extreme Mechanics Letters September 2023 63

A stochastic description of pH within nanoscopic water pools

Authors: Li, Sirui, Kwon, Soonho, Goddard, William A., III, Houle, Frances A.

Source: In Cell Reports Physical Science 21 June 2023 4(6)

Predicted structure and cell signaling of TAS2R14 reveal receptor hyper-flexibility for detecting diverse bitter tastes

Authors: Tokmakova, Alina ^{1, 6, 7}, Kim, Donghwa ^{2, 3, 7}, Guthrie, Brian ⁴, Kim, Soo-Kyung ¹, Goddard, William A., III ^{1, 8, ∗}, Liggett, Stephen B. ^{2, 3, 5, 8, ∗∗}

Source: In iScience 21 April 2023 26(4)

Low temperature synthesis of new highly graphitized N-doped carbon for Pt fuel cell supports, satisfying DOE 2025 durability standards for both catalyst and support

Authors: Lee, Ha-Young, Yu, Ted H., Shin, Cheol-Hwan, Fortunelli, Alessandro, Ji, Sang Gu, Kim, Yujin, Kang, Tong-Hyun, Lee, Byong-June, Merinov, Boris V., Goddard, William A., III, Choi, Chang Hyuck, Yu, Jong-Sung

Source: In Applied Catalysis B: Environment and Energy April 2023 323

Quantum-mechanics-based molecular dynamics simulations of the structure and performance of sulfur-enriched Li3PS4 cathodes

Authors: Morozov, Sergey I., Merinov, Boris V., Das, Tridip, Zybin, Sergey V., Yang, Moon Young, Goddard, William A., III

Source: In Cell Reports Physical Science 15 March 2023 4(3)