Journal articles on the topic 'Valance (Theoretical chemistry)'
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Ming-Dan, Chen, and Hu Sheng-Zhi. "Study on the Bond Valance Parameters Related to Lanthanoid." Acta Physico-Chimica Sinica 18, no. 12 (2002): 1104–9. http://dx.doi.org/10.3866/pku.whxb20021210.
Full textKassaee, M. Z., S. Arshadi, B. N. Haerizade, and E. Vessally. "Electronic effects on 1H-azepines valance tautomerization: an ab initio comparative study." Journal of Molecular Structure: THEOCHEM 731, no. 1-3 (October 2005): 29–37. http://dx.doi.org/10.1016/j.theochem.2005.02.087.
Full textDeng, J. K., G. Q. Li, F. Wang, G. L. Su, C. G. Ning, T. Zhang, X. G. Ren, Y. Wang, and Y. Zheng. "The outer valance orbital electron densities of cyclopentane by binary (e,2e) spectroscopy." Journal of Chemical Physics 120, no. 21 (June 2004): 10009–14. http://dx.doi.org/10.1063/1.1737296.
Full textGuan, Xiangjiu, Shichao Zong, Li Tian, Yazhou Zhang, and Jinwen Shi. "Construction of SrTiO3–LaCrO3 Solid Solutions with Consecutive Band Structures for Photocatalytic H2 Evolution under Visible Light Irradiation." Catalysts 12, no. 10 (September 27, 2022): 1123. http://dx.doi.org/10.3390/catal12101123.
Full textWang, Gang, Jinju Zheng, Boyi Xu, Chaonan Zhang, Yue Zhu, Zhi Fang, Zuobao Yang, Ming-Hui Shang, and Weiyou Yang. "Tailored Electronic Band Gap and Valance Band Edge of Nickel Oxide via p-Type Incorporation." Journal of Physical Chemistry C 125, no. 13 (March 24, 2021): 7495–501. http://dx.doi.org/10.1021/acs.jpcc.1c01463.
Full textCao, Xiaochun, Ruihua Cheng, Zhen Liu, Lisong Wang, Qi Dong, Xuelian He, and Boping Liu. "DFT and PIO study of the influences of Mo valance state and surface hydroxyl on supported-MoOx catalysts for ethylene polymerization." Journal of Molecular Catalysis A: Chemical 321, no. 1-2 (April 14, 2010): 50–60. http://dx.doi.org/10.1016/j.molcata.2010.01.018.
Full textManjula, Saravanan, Chinnasamy Kalaiarasi, Mysore S. Pavan, Venkatesha R. Hathwar, and Poomani Kumaradhas. "Charge density and electrostatic potential of hepatitis C anti-viral agent andrographolide: an experimental and theoretical study." Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 74, no. 6 (November 23, 2018): 693–704. http://dx.doi.org/10.1107/s2052520618014981.
Full textLee, Yuan-Gee, Ya-Tian Hou, and Yu-Ching Weng. "Amperometric Oxygen Sensor Based on Bimetallic Pd-Cu/C Electrocatalysts." Catalysts 11, no. 10 (September 29, 2021): 1189. http://dx.doi.org/10.3390/catal11101189.
Full textSimfukwe, Joseph, Refilwe Edwin Mapasha, Artur Braun, and Mmantsae Diale. "Ab Initio Studies of Bimetallic-Doped {0001} Hematite Surface for Enhanced Photoelectrochemical Water Splitting." Catalysts 11, no. 8 (August 3, 2021): 940. http://dx.doi.org/10.3390/catal11080940.
Full textPal, Sachindranath, Anil Kumar Barik, Samik Gupta, Somnath Roy, Tarak Nath Mandal, Arijit Hazra, Mohamed Salah El Fallah, et al. "Anion dependent formation of linear trinuclear mixed valance cobalt(III/II/III) complexes and mononuclear cobalt(III) complexes of a pyrazole derived ligand – Synthesis, characterization and X-ray structures." Polyhedron 27, no. 1 (January 2008): 357–65. http://dx.doi.org/10.1016/j.poly.2007.09.037.
Full textLevy-Gigi, Einat, Reut Donner, and George A. Bonanno. "Free Your Mind: Emotional Expressive Flexibility Moderates the Effect of Stress on Post-Traumatic Stress Disorder Symptoms." International Journal of Molecular Sciences 21, no. 15 (July 28, 2020): 5355. http://dx.doi.org/10.3390/ijms21155355.
Full textLadislav, Valach. "Integrating Psychotherapy and Occupational Counselling in Family Projects: An Action Theoretical View." Psychology and Mental Health Care 3, no. 1 (March 7, 2019): 01–07. http://dx.doi.org/10.31579/2637-8892/009.
Full textPancheri, Francesco Q., and Luis Dorfmann. "STRAIN-CONTROLLED BIAXIAL TENSION OF NATURAL RUBBER: NEW EXPERIMENTAL DATA." Rubber Chemistry and Technology 87, no. 1 (March 1, 2014): 120–38. http://dx.doi.org/10.5254/rct.13.87902.
Full textOgden, R. W. "Recent Advances in the Phenomenological Theory of Rubber Elasticity." Rubber Chemistry and Technology 59, no. 3 (July 1, 1986): 361–83. http://dx.doi.org/10.5254/1.3538206.
Full textWen, Liping, and Baoshun Liu. "Kinetic pathways of sub-bandgap induced electron transfer in Ag/TiO2 and the effect on isopropanol dehydrogenation under gaseous conditions." Physical Chemistry Chemical Physics, 2024. http://dx.doi.org/10.1039/d3cp05897b.
Full textCao, Jin, Dongdong Zhang, Yilei Yue, Xuelin Yang, Chenwu Yang, Jingjing Niu, Zhiyuan Zeng, et al. "Unveiling the X‐Ray Absorption Chemistry of H3.78V6O13 Cathode for Aqueous Zinc‐Ion Batteries." Advanced Functional Materials, September 2023. http://dx.doi.org/10.1002/adfm.202307270.
Full textManjula, Selvam, Ganesan Sivakumar, Panneerselvam Dhamodharan, Ayyar Dinesh, Saravana Kumar Jaganathan, and Manikandan Ayyar. "Hydrothermal synthesis of Cu2CoSnS4 nanoparticles: characterization and their applications of electrochemical, antibacterial and photocatalytic performances." Zeitschrift für Physikalische Chemie, January 3, 2024. http://dx.doi.org/10.1515/zpch-2023-0428.
Full textHepting, Matthias, Mark P. M. Dean, and Wei-Sheng Lee. "Soft X-Ray Spectroscopy of Low-Valence Nickelates." Frontiers in Physics 9 (December 22, 2021). http://dx.doi.org/10.3389/fphy.2021.808683.
Full textIdrissi, Samira, Abderrahim Jabar, and Lahoucine Bahmad. "Origin of semiconductor and half‐metallic behaviors in the perovskite materials RbXF3 (X = Co, Mn, Fe or V): A GGA + U approach." International Journal of Quantum Chemistry 124, no. 2 (January 11, 2024). http://dx.doi.org/10.1002/qua.27341.
Full textNishkala, K. R., Rajat Radhakrishna Rao, Srinivas Mutalik, and Mamatha D. Daivajna. "Effect of La substitution on the structural and chemical properties of Barium hexaferrite via Mossbauer spectroscopy." Hyperfine Interactions 244, no. 1 (February 14, 2023). http://dx.doi.org/10.1007/s10751-023-01818-5.
Full textErum, Nazia, Ramesh Sharma, Nadia Anwar, Samah Al‐Qaisi, Murefah mana Al‐Anazy, and El Sayed Yousef. "Enhanced mechanical, optoelectronic and thermoelectric properties of binary CdO by under pressure: An ab initio study." International Journal of Quantum Chemistry 124, no. 5 (February 24, 2024). http://dx.doi.org/10.1002/qua.27360.
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