Authors: Yadav, Mamta1 (AUTHOR), Singh, Ankit1 (AUTHOR) ankitsinghphy@gmail.com, Singh, Yashwant1 (AUTHOR)
Superior Title: Journal of Chemical Physics. 5/7/2024, Vol. 160 Issue 17, p1-9. 9p.
Subject Terms: *THERMODYNAMICS, *GIBBS' energy diagram, *PSEUDOPOTENTIAL method, *PROPERTIES of fluids, *DENSITY matrices, *POROUS materials
Authors: Sciortino, Francesco1 (AUTHOR) francesco.sciortino@uniroma1.it, Gartner III, Thomas E.2 (AUTHOR), Debenedetti, Pablo G.3 (AUTHOR)
Superior Title: Journal of Chemical Physics. 3/14/2024, Vol. 160 Issue 10, p1-7. 7p.
Subject Terms: *GIBBS' energy diagram, *CRITICAL temperature, *METASTABLE states, *CRITICAL point (Thermodynamics)
Authors: Serva, Alessandra1 (AUTHOR) alessandra.serva@sorbonne-universite.fr, Pezzotti, Simone2 (AUTHOR) simone.pezzotti@rub.de
Superior Title: Journal of Chemical Physics. 3/7/2024, Vol. 160 Issue 9, p1-7. 7p.
Subject Terms: *SOLVATION, *GIBBS' energy diagram, *ELECTROCATALYSIS, *MOLECULAR dynamics, *ELECTROCHEMISTRY
Authors: Snyder, Ryan1 (AUTHOR), Kim, Bryant1 (AUTHOR), Pan, Xiaoliang2 (AUTHOR), Shao, Yihan2 (AUTHOR), Pu, Jingzhi1 (AUTHOR) yihan.shao@ou.edu
Superior Title: Journal of Chemical Physics. 8/7/2023, Vol. 159 Issue 5, p1-12. 12p.
Subject Terms: *KRIGING, *GIBBS' energy diagram, *ACTIVATION energy, *NUCLEAR reactions, *POTENTIAL energy, *ENERGY industries
Authors: Widmer, Julian1 (AUTHOR), Langini, Cassiano1 (AUTHOR), Vitalis, Andreas1 (AUTHOR), Caflisch, Amedeo1 (AUTHOR) caflisch@bioc.uzh.ch
Superior Title: Journal of Chemical Physics. 7/7/2023, Vol. 159 Issue 1, p1-21. 21p.
Subject Terms: *GIBBS' energy diagram, *COORDINATES, *MARKOV processes, *PEPTIDES, *SPATIAL resolution
Authors: Zheng, Jingjing, Frisch, Michael J.
Superior Title: Journal of Chemical Physics; 4/14/2024, Vol. 160 Issue 14, p1-11, 11p
Authors: Ghysbrecht, Simon1 (AUTHOR), Keller, Bettina G.1 (AUTHOR) bettina.keller@fu-berlin.de
Superior Title: Journal of Computational Chemistry. Jun2024, Vol. 45 Issue 16, p1390-1403. 14p.
Subject Terms: *GIBBS' energy diagram, *MOLECULAR dynamics, *ISOMERIZATION, *CHEMICAL models, *CHEMICAL reactions, *DENSITY functional theory
Authors: Liu, Zhuo1 (AUTHOR), Cao, Xueting1 (AUTHOR), Ma, Zhenyu1 (AUTHOR), Xu, Limei2 (AUTHOR), Wang, Lushan2 (AUTHOR), Li, Jian3 (AUTHOR), Xiao, Min1 (AUTHOR), Jiang, Xukai1 (AUTHOR) xukai.jiang@sdu.edu.cn
Superior Title: International Journal of Molecular Sciences. May2024, Vol. 25 Issue 10, p5486. 18p.
Subject Terms: *MOLECULAR dynamics, *GIBBS' energy diagram, *GLUCOSE transporters, *ANTINEOPLASTIC agents, *GLYCOCONJUGATES
Authors: Singh, Amritpal1 (AUTHOR) amritpalghumman@gmail.com, Chayawan, Chayawan2 (AUTHOR), Deol, Yadwinder Singh3 (AUTHOR), Kumar, Santosh4 (AUTHOR), Kumar, Rajesh4 (AUTHOR), Mittal, Lalit Singh5 (AUTHOR)
Superior Title: Molecular Simulation. May/Jun2024, Vol. 50 Issue 7-9, p528-538. 11p.
Subject Terms: *AMINATION, *GIBBS' energy diagram, *HYDROGEN bonding interactions, *ETHYLENE, *MOIETIES (Chemistry), *AMINES
Authors: Tsipis, Athanassios C.1 (AUTHOR) attsipis@uoi.gr, Sarantou, Antonia A.1 (AUTHOR)
Superior Title: Dalton Transactions: An International Journal of Inorganic Chemistry. 4/21/2024, Vol. 53 Issue 15, p6791-6801. 11p.
Subject Terms: *GIBBS' energy diagram, *PHOTOREDUCTION, *ELECTRON donors, *PROTON transfer reactions, *REDUCTION potential, *ELECTRONIC structure
Authors: Shoemaker, Brian A., Haji-Akbari, Amir
Superior Title: Journal of Chemical Physics; 1/14/2024, Vol. 160 Issue 2, p1-18, 18p
Subject Terms: ION transport (Biology), CONDUCTORS (Musicians), GIBBS' energy diagram, IONS, DIELECTRIC properties
Authors: Lai, King C.1,2 (AUTHOR), Liu, Da-Jiang1 (AUTHOR), Evans, James W.1,2 (AUTHOR) evans@ameslab.gov
Superior Title: Journal of Chemical Physics. 3/14/2023, Vol. 158 Issue 10, p1-10. 10p.
Subject Terms: *GIBBS' energy diagram, *MONTE Carlo method, *NANOCRYSTALS, *DISCONTINUOUS precipitation, *STOCHASTIC models
Authors: Cruzeiro, Vinícius Wilian D.1,2 (AUTHOR), Wang, Yuanheng1,2 (AUTHOR), Pieri, Elisa1,2 (AUTHOR), Hohenstein, Edward G.1,2 (AUTHOR), Martínez, Todd J.1,2 (AUTHOR) toddjmartinez@gmail.com
Superior Title: Journal of Chemical Physics. 1/28/2023, Vol. 158 Issue 4, p1-9. 9p.
Subject Terms: *GIBBS' energy diagram, *GRAPHICS processing units, *GREEN fluorescent protein, *ELECTRONIC structure, *PYTHON programming language, *PROGRAMMING languages, *QUANTUM mechanics
Company/Entity: GOOGLE Inc. GOOG
Authors: Blanc, Florian E. C.1, Hummer, Gerhard1,2
Superior Title: Proceedings of the National Academy of Sciences of the United States of America. 3/12/2024, Vol. 121 Issue 11, p1-10. 31p.
Subject Terms: *ADENOSINE triphosphatase, *GIBBS' energy diagram, *ROTATIONAL motion, *ADENOSINE triphosphate, *MITOCHONDRIA
Authors: Tolbatov, Iogann1 (AUTHOR) paolo.umari@unipd.it, Umari, Paolo1 (AUTHOR), Marrone, Alessandro2 (AUTHOR) amarrone@unich.it
Superior Title: International Journal of Molecular Sciences. Mar2024, Vol. 25 Issue 5, p2625. 10p.
Subject Terms: *GIBBS' energy diagram, *SELENOCYSTEINE, *CARBENES, *DENSITY functional theory, *THIOREDOXIN, *ANTINEOPLASTIC agents
Authors: Yuan, Jinyun1 (AUTHOR) yuanjinyun0916@iccas.ac.cn, Luo, Qiquan2 (AUTHOR), Zhang, Yonghui1 (AUTHOR), Chen, Junli1 (AUTHOR), Zhang, Wenhua3 (AUTHOR) whhzhang@ustc.edu.cn, Yang, Jinlong3 (AUTHOR) jlyang@ustc.edu.cn
Superior Title: Catalysis Letters. Mar2024, Vol. 154 Issue 3, p1351-1358. 8p.
Subject Terms: *GIBBS' energy diagram, *GRAPHENE, *METHANE, *METHANOL, *ACTIVATION energy, *COPPER, *METHANOL as fuel
Authors: Boutiddar, Rachid1,2 (AUTHOR), Abbiche, Khalid1,2,3 (AUTHOR) k.abbiche@uiz.ac.ma, Mellaoui, Moulay Driss3 (AUTHOR), Imjjad, Abdallah3 (AUTHOR), Alahiane, Mustapha4 (AUTHOR), Ait Albrimi, Youssef4 (AUTHOR), Marakchi, Khadija2 (AUTHOR), Mogren Al‐Mogren, Muneerah5 (AUTHOR), El Hammadi, Abdellatif1 (AUTHOR), Hochlaf, Majdi6 (AUTHOR) majdi.hochlaf@univ-eiffel.fr
Superior Title: Journal of Computational Chemistry. 2/15/2024, Vol. 45 Issue 5, p284-299. 16p.
Subject Terms: *KINETIC control, *GIBBS' energy diagram, *GAS phase reactions, *RING formation (Chemistry), *GIBBS' free energy, *MALEIMIDES
Authors: Malgaretti, Paolo1 (AUTHOR) p.malgaretti@fz-juelich.de, Pagonabarraga, Ignacio2,3 (AUTHOR), Harting, Jens1,4 (AUTHOR)
Superior Title: European Physical Journal E -- Soft Matter. Feb2024, Vol. 47 Issue 2, p1-13. 13p.
Subject Terms: *GIBBS' energy diagram, *ELECTROLYTES
Authors: Nguyen, Cao Thang1 (AUTHOR), Ho, Duc Tam2 (AUTHOR), Kim, Sung Youb1 (AUTHOR) sykim@unist.ac.kr
Superior Title: Advanced Theory & Simulations. Jan2024, Vol. 7 Issue 1, p1-7. 7p.
Subject Terms: *SOLID-liquid interfaces, *GIBBS' energy diagram, *FREE energy (Thermodynamics), *ATOMIC interactions, *ATOMIC models, *COPPER
Authors: Dietschreit, Johannes C. B.1 (AUTHOR), Diestler, Dennis J.2 (AUTHOR), Hulm, Andreas3 (AUTHOR), Ochsenfeld, Christian3,4 (AUTHOR), Gómez-Bombarelli, Rafael1 (AUTHOR) rafagb@mit.edu
Superior Title: Journal of Chemical Physics. 8/28/2022, Vol. 157 Issue 8, p1-12. 12p.
Subject Terms: *GIBBS' energy diagram, *CHEMICAL models, *CHEMICAL reactions, *POTENTIAL energy surfaces, *CHEMICAL systems, *FREE energy (Thermodynamics)