المؤلفون: Chaker Briki, Maha M. Almoneef, Abdelhakim Settar, Mbarek Mohamed, Abdelmajid Jemni

المصدر: Heliyon, Vol 10, Iss 10, Pp e31019- (2024)

مصطلحات موضوعية: Amorphous alloy, Mg50Ni50, Desorption, Activation energy, Formation enthalpy, Formation entropy, Science (General), Q1-390, Social sciences (General), H1-99

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S2405844024070506; https://doaj.org/toc/2405-8440

URL الوصول: https://doaj.org/article/60c16670d3264ff4a909f4948f098384

المؤلفون: Soe, Chan Myae Myae, Nagabhushana, GP, Shivaramaiah, Radha, Tsai, Hsinhan, Nie, Wanyi, Blancon, Jean-Christophe, Melkonyan, Ferdinand, Cao, Duyen H, Traoré, Boubacar, Pedesseau, Laurent, Kepenekian, Mikaël, Katan, Claudine, Even, Jacky, Marks, Tobin J, Navrotsky, Alexandra, Mohite, Aditya D, Stoumpos, Constantinos C, Kanatzidis, Mercouri G

المصدر: Proceedings of the National Academy of Sciences of the United States of America. 116(1)

مصطلحات موضوعية: Macromolecular and Materials Chemistry, Chemical Sciences, Physical Chemistry, Affordable and Clean Energy, layered compounds, homologous series, Ruddlesden-Popper halide perovskites, formation enthalpy, photovoltaics, Ruddlesden–Popper halide perovskites

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/3zr0m35q
https://escholarship.org/content/qt3zr0m35q/qt3zr0m35q.pdf

المؤلفون: Chen, Jiewei, Calvin, Jason, Asplund, Megan, King, Sean W, Woodfield, Brian F, Navrotsky, Alexandra

مصطلحات موضوعية: Heat capacity, Entropy Gibbs free energy, Amorphous low-k SiOCH films, Formation enthalpy, Thermodynamic stability, Physical Chemistry (incl. Structural), Theoretical and Computational Chemistry, Interdisciplinary Engineering, Chemical Engineering

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/49n4f520

المؤلفون: Chen, J, Calvin, J, Asplund, M, King, SW, Woodfield, BF, Navrotsky, A

مصطلحات موضوعية: Heat capacity, Entropy Gibbs free energy, Amorphous low-k SiOCH films, Formation enthalpy, Thermodynamic stability, Physical Chemistry (incl. Structural), Theoretical and Computational Chemistry, Interdisciplinary Engineering, Chemical Engineering

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/49n4f520

المؤلفون: Kübra Gürpınar, Yaprak Gürsoy Tuncer, Ş. Betül Sopacı, M. Abdulkadir Akay, Hasan Nazır, Ingrid Svoboda, Orhan Atakol, Emine Kübra İnal

المصدر: Acta Chimica Slovenica, Vol 68, Iss 4, Pp 930-944 (2021)

مصطلحات موضوعية: energetic material, nitrogen-rich material, formation enthalpy, thermokinetic analysis, kamlet-jacobs equation, antimicrobial activity, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://journals.matheo.si/index.php/ACSi/article/view/6904; https://doaj.org/toc/1318-0207; https://doaj.org/toc/1580-3155

URL الوصول: https://doaj.org/article/3e867e0cf5464422a4f5f636073e6db0

المؤلفون: Sadovnikov, S. I., Kostenko, M. G., Gusev, A. I., Lukoyanov, A. V.

المصدر: Nanomaterials

مصطلحات موضوعية: CRYSTAL STRUCTURE PREDICTIONS, ELASTIC CONSTANTS, ELECTRONIC STRUCTURE, FORMATION ENTHALPY, HARDNESS, MECHANICAL STABILITY, SILVER SULFIDE

وصف الملف: application/pdf

Relation: Sadovnikov, SI, Kostenko, MG, Gusev, AI & Lukoyanov, AV 2023, 'Low-Temperature Predicted Structures of Ag2S (Silver Sulfide)', Nanomaterials, Том. 13, № 19, 2638. https://doi.org/10.3390/nano13192638; Sadovnikov, S. I., Kostenko, M. G., Gusev, A. I., & Lukoyanov, A. V. (2023). Low-Temperature Predicted Structures of Ag2S (Silver Sulfide). Nanomaterials, 13(19), [2638]. https://doi.org/10.3390/nano13192638; Final; All Open Access, Gold, Green; https://www.scopus.com/inward/record.uri?eid=2-s2.0-85173850553&doi=10.3390%2fnano13192638&partnerID=40&md5=ba24624df4629076e93820589f9e8c05; https://www.mdpi.com/2079-4991/13/19/2638/pdf?version=1695699642; http://elar.urfu.ru/handle/10995/130852; 85173850553; 001085059300001

الاتاحة: http://elar.urfu.ru/handle/10995/130852
https://www.scopus.com/inward/record.uri?eid=2-s2.0-85173850553&doi=10.3390%2fnano13192638&partnerID=40&md5=ba24624df4629076e93820589f9e8c05
https://www.mdpi.com/2079-4991/13/19/2638/pdf?version=1695699642
https://doi.org/10.3390/nano13192638

المؤلفون: Nuta, Ioana, Virot, François, Fischer, Evelyne, Chatillon, Christian

المساهمون: Science et Ingénierie des Matériaux et Procédés (SIMaP), Institut de Chimie - CNRS Chimie (INC-CNRS)-Centre National de la Recherche Scientifique (CNRS)-Université Grenoble Alpes (UGA)-Institut polytechnique de Grenoble - Grenoble Institute of Technology (Grenoble INP), Université Grenoble Alpes (UGA), Laboratoire d'étude de transfert des radioéléments (IRSN/PSN-RES/SAM/LETR), Service des Accidents Majeurs (IRSN/PSN-RES/SAM), Institut de Radioprotection et de Sûreté Nucléaire (IRSN)-Institut de Radioprotection et de Sûreté Nucléaire (IRSN), IRSN-contract number LS20317

المصدر: ISSN: 0364-5916 ; Calphad ; https://hal.science/hal-04098610 ; Calphad, 2023, 80, pp.102508. ⟨10.1016/j.calphad.2022.102508⟩.

مصطلحات موضوعية: RuO 4, Ru-O, Entropy, Formation enthalpy, [CHIM.INOR]Chemical Sciences/Inorganic chemistry

الاتاحة: https://hal.science/hal-04098610
https://hal.science/hal-04098610v1/document
https://hal.science/hal-04098610v1/file/CALPHAD_Thermodynamic%20assessment%20of%20RuO4_v18.pdf
https://doi.org/10.1016/j.calphad.2022.102508

المؤلفون: Alexander G. Ivanov, Dmitri A. Karpov, Evgeniy S. Chebukov, Michael I. Yurchenkov

المصدر: Hydrogen; Volume 4; Issue 2; Pages: 226-236

مصطلحات موضوعية: metal hydride, hydrogen accumulator, Ni-Mg-Ni-Mg film structure, X-ray diffraction analysis, sorption/desorption process, mass content of hydrogen, phase-formation enthalpy

وصف الملف: application/pdf

Relation: https://dx.doi.org/10.3390/hydrogen4020016

الاتاحة: https://doi.org/10.3390/hydrogen4020016

المساهمون: Navrotsky, Alexandra [Univ. of California, Davis, CA (United States)]

المصدر: Acta Materialia; 97; C; Other Information: MSA partners with University of Notre Dame (lead); University of California, Davis; Florida State University; George Washington University; University of Michigan; University of Minnesota; Oak Ridge National Laboratory; Oregon state University; Rensselaer Polytechnic Institute; Savannah River National Laboratory

وصف الملف: Medium: ED; Size: p. 191-198

URL الوصول: http://www.osti.gov/scitech/servlets/purl/1370874

المؤلفون: Kai Xu, Shuhong Liu, Keke Chang, Yongpeng Liang, Yong Du, Zhanpeng Jin

المصدر: Journal of Magnesium and Alloys, Vol 9, Iss 1, Pp 144-155 (2021)

مصطلحات موضوعية: LPSOs, Thermodynamic model, Formation enthalpy, CALPHAD, Solidification, Mining engineering. Metallurgy, TN1-997

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S2213956720300840; https://doaj.org/toc/2213-9567

URL الوصول: https://doaj.org/article/f4216b8a2545408d92a897e63dd28977

المؤلفون: Yu. V. Popov, A. S. Dolgachev, E. V. Shishkin, Yu. L. Zotov, V. E. Shishkin

المصدر: Тонкие химические технологии, Vol 15, Iss 2, Pp 30-37 (2020)

مصطلحات موضوعية: alkali metal xanthates, semi-empirical quantum chemical calculation methods, correlation analysis, formation enthalpy, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://www.finechem-mirea.ru/jour/article/view/1595; https://doaj.org/toc/2410-6593; https://doaj.org/toc/2686-7575

URL الوصول: https://doaj.org/article/a7dbc4852b424ada88dbe7b6bc601452

المؤلفون: Kothakonda, Manish, Kaplan, Aaron, Isaacs, Eric B., Bartel, Christopher J., Furness, James W., Ning, Jinliang, Wolverton, Chris, Perdew, John P., Sun, Jianwei, Kaplan|0000-0003-3439-4856

مصطلحات موضوعية: Density functional theory, Meta-generalized gradient approximation (meta-GGA), Van der Waals interaction, Formation enthalpy, Decomposistion enthalpy, Solid-state materials

وصف الملف: 10 pages

Relation: American Chemical Society (ACS); http://dx.doi.org/10.1021/acsmaterialsau.2c00059; ACS Materials Au, Vol. 3, Iss. 2; Faculty/ Researcher Works; Testing the r2SCAN Density Functional for the Thermodynamic Stability of Solids with and without a van der Waals Correction Manish Kothakonda, Aaron D. Kaplan, Eric B. Isaacs, Christopher J. Bartel, James W. Furness, Jinliang Ning, Chris Wolverton, John P. Perdew, and Jianwei Sun ACS Materials Au 2023 3 (2), 102-111 DOI:10.1021/acsmaterialsau.2c00059; http://hdl.handle.net/20.500.12613/10021

الاتاحة: https://hdl.handle.net/20.500.12613/10021

المؤلفون: Aiyuan Ma, Bingguo Liu, Chao Yuwen, Libo Zhang, Peng Liu, Siyu Gong

المصدر: ISIJ International. 2022, 62(9):1802

المؤلفون: Tammireddy, Sandhya

Thesis Advisors: Deibel, Carsten, Kahmann, Simon, Technische Universität Chemnitz

مصطلحات موضوعية: Organic–inorganic hybrid Perovskites, Perovskite, Solar cells, Impedance spectroscopy, Deep level spectroscopy, Ionic defects, Hysteresis, Formation Enthalpy, Migration enthalpy, Formation entropy, Long-range and short-range conduction, organisch-inorganische hybride Halbleiter, Perowskit, Solarzellen, Transiente Störstellenspektroskopie, Impedanzspektroskopie, ionische Defekte, Hysterese, Migrationsenthalpie, Bildungsenthalpie und Entropie, Lang und Kurzstreckenleitung, info:eu-repo/classification/ddc/530, ddc:530

الاتاحة: https://monarch.qucosa.de/id/qucosa%3A93832
https://monarch.qucosa.de/api/qucosa%3A93832/attachment/ATT-0/
https://monarch.qucosa.de/api/qucosa%3A93832/attachment/ATT-2/

المساهمون: Asta, M. [Univ. of California, Berkeley, CA (United States). Dept. of Materials Science and Engineering; Univ. of California, Davis, CA (United States). Dept. of Chemical Engineering and Materials Science]

المصدر: Acta Materialia; 78; C

وصف الملف: Medium: ED; Size: p. 282-289

URL الوصول: http://www.osti.gov/scitech/servlets/purl/1305821

المؤلفون: Volodymyr Dibrivnyi, Andriy Marshalek, Iryna Sobechko, Yuriy Horak, Mykola Obushak, Nadiia Velychkivska, Lubomyr Goshko

المصدر: BMC Chemistry, Vol 13, Iss 1, Pp 1-11 (2019)

مصطلحات موضوعية: Arylfuran derivatives, Vapor pressure, Combustion enthalpy, Formation enthalpy, Sublimation enthalpy, Isomerization, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: http://link.springer.com/article/10.1186/s13065-019-0619-2; https://doaj.org/toc/2661-801X

URL الوصول: https://doaj.org/article/b70c440cb53a49e99f2b5b3517d35de5

المؤلفون: WU Ya-xin, CAO Chen-zhong, TENG Li-li

المصدر: Chinese Journal of Magnetic Resonance, Vol 36, Iss 1, Pp 65-73 (2019)

مصطلحات موضوعية: alkanes, formation enthalpy, 13C NMR, chemical shift, path counts of length three bounds (P3), Electricity and magnetism, QC501-766

وصف الملف: electronic resource

Relation: http://html.rhhz.net/bpxzz/html/20190107.htm; https://doaj.org/toc/1000-4556

URL الوصول: https://doaj.org/article/3a857dc26e0e4fe79ac649c43c048ccd

المؤلفون: Chaiyawat Kaewmeechai, Yongyut Laosiritaworn, Atchara Punya Jaroenjittichai

المصدر: Results in Physics, Vol 25, Iss , Pp 104225- (2021)

مصطلحات موضوعية: perovskite, solar cells, formation enthalpy, decomposition energy, structural stability, DFT, Physics, QC1-999

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S2211379721003697; https://doaj.org/toc/2211-3797

URL الوصول: https://doaj.org/article/b349e9bc013c45f78b14b6d7eb59f618

المؤلفون: Bangwei Zhang, Chun Zhang, Kaiyan Cui, Shuang Yang, Shuzhi Liao

المصدر: MATERIALS TRANSACTIONS. 2022, 63(5):676

المؤلفون: Lu, Eryang, Zhao, Junlei, Makkonen, Ilja, Mizohata, Kenichiro, Li, Zhiming, Hua, Mengyuan, Djurabekova, Flyura, Tuomisto, Filip

المساهمون: Department of Physics, Helsinki Institute of Physics

مصطلحات موضوعية: Density functional theory calculations, FORMATION ENTHALPY, High entropy alloys, INITIO MOLECULAR-DYNAMICS, IRRADIATION, Interstitials, POSITRON-ANNIHILATION, Positron annihilation, RADIATION-DAMAGE, SEMICONDUCTORS, SLUGGISH DIFFUSION, STRENGTH, TOTAL-ENERGY CALCULATIONS, TRACER DIFFUSION, Vacancy, Physical sciences

وصف الملف: application/pdf

Relation: Lu , E , Zhao , J , Makkonen , I , Mizohata , K , Li , Z , Hua , M , Djurabekova , F & Tuomisto , F 2021 , ' Enhancement of vacancy diffusion by C and N interstitials in the equiatomic FeMnNiCoCr high entropy alloy ' , Acta Materialia , vol. 215 , 117093 . https://doi.org/10.1016/j.actamat.2021.117093; RIS: urn:69A4FC5FF3417B3EC64DC67D9D96E611; ORCID: /0000-0002-5828-200X/work/99887911; ORCID: /0000-0003-1703-2247/work/99888300; ORCID: /0000-0003-4134-8428/work/99890682; ORCID: /0000-0002-6913-5654/work/99890689; ORCID: /0000-0001-8355-4612/work/99890748; http://hdl.handle.net/10138/334317; e2d2131a-5c5b-4649-a3fc-7a18e3b4369a; 85109584096; 000684229400056

الاتاحة: http://hdl.handle.net/10138/334317