Works matching Chemical bond lengths

Results: 1258

Chemical Speciation and Bond Lengths of Organic Solutes by Core-Level Spectroscopy: pH and Solvent Influence on p-Aminobenzoic Acid.

Published in:

Chemistry - A European Journal, 2015, v. 21, n. 19, p. 7256, doi. 10.1002/chem.201405635

By:

Stevens, Joanna S.;
Gainar, Adrian;
Suljoti, Edlira;
Xiao, Jie;
Golnak, Ronny;
Aziz, Emad F.;
Schroeder, Sven L. M.

Publication type:

Article

A Novel Strategy for Comprehensive Estimation of Lattice Energy, Bulk Modulus, Chemical Hardness and Electronic Polarizability of A N B 8-N Binary Inorganic Crystals.

Published in:

Crystals (2073-4352), 2023, v. 13, n. 4, p. 668, doi. 10.3390/cryst13040668

By:

Zhao, Xinyu;
Wang, Xiaoli

Publication type:

Article

The Second Protonation in the Bio-Catalytic Cycles of the Enzymes Cytochrome P450 and Superoxide Reductase.

Published in:

Reactions (2624-781X), 2024, v. 5, n. 4, p. 778, doi. 10.3390/reactions5040039

By:

Spataru, Tudor;
Dascalu, Lisa Maria;
Moraru, Andreea;
Moraru, Mariana

Publication type:

Article

A Series of Diamagnetic Pyridine Monoimine Rhenium Complexes with Different Degrees of Metal-to-Ligand Charge Transfer: Correlating 13C NMR Chemical Shifts with Bond Lengths in Redox-Active Ligands.

Published in:

Chemistry - A European Journal, 2016, v. 22, n. 30, p. 10638, doi. 10.1002/chem.201600679

By:

Sieh, Daniel;
Kubiak, Clifford P.

Publication type:

Article

Associations between ALDOB polymorphisms and intrahepatic cholestasis of pregnancy susceptibility in the Chinese Han population.

Published in:

Ginekologia Polska, 2024, v. 95, n. 3, p. 132, doi. 10.5603/gpl.92931

By:

Xianxian Liu;
Siming Xin;
Jiusheng Zheng;
Huai Liu;
Yang Zeng;
Xiaoying Wu;
Feng Zhang;
Xiaoming Zeng;
Yang Zou;
Hua Lai

Publication type:

Article

Associations between ALDOB polymorphisms and intrahepatic cholestasis of pregnancy susceptibility in the Chinese Han population.

Published in:

Ginekologia Polska, 2024, v. 95, n. 2, p. 132, doi. 10.5603/gpl.92931

By:

Xianxian Liu;
Siming Xin;
Jiusheng Zheng;
Huai Liu;
Yang Zeng;
Xiaoying Wu;
Feng Zhang;
Xiaoming Zeng;
Yang Zou;
Hua Lai

Publication type:

Article

How 5 f Electron Polarisability Drives Covalency and Selectivity in Actinide N‐Donor Complexes.

Published in:

Chemistry - A European Journal, 2021, v. 27, n. 72, p. 18058, doi. 10.1002/chem.202102849

By:

Köhler, Luisa;
Patzschke, Michael;
Schmidt, Moritz;
Stumpf, Thorsten;
März, Juliane

Publication type:

Article

Self‐Expanding Ion‐Transport Channels on Anodes for Fast‐Charging Lithium‐Ion Batteries.

Published in:

Angewandte Chemie, 2022, v. 134, n. 7, p. 1, doi. 10.1002/ange.202113313

By:

An, Juan;
Zhang, Hongyu;
Qi, Lu;
Li, Guoxing;
Li, Yuliang

Publication type:

Article

Liquid Structure of Iron and Iron–Nitrogen–Carbon Alloys Within the Cores of Small Terrestrial Bodies.

Published in:

Journal of Geophysical Research. Planets, 2025, v. 130, n. 1, p. 1, doi. 10.1029/2024JE008599

By:

Pease, Allison;
Liu, Jiachao;
Lv, Mingda;
Piper, Jack;
Kono, Yoshio;
Dorfman, Susannah M.

Publication type:

Article

Structural and Optical Properties of ZnO:Al Thin Films Produced by Magnetron Sputtering with Different Oxygen Flow: An Experimental and Ab Initio Study.

Published in:

Physica Status Solidi. A: Applications & Materials Science, 2020, v. 217, n. 19, p. 1, doi. 10.1002/pssa.202000167

By:

Queiroz, José César Augusto de;
Filho, João Batista de Azevedo;
Feitor, Michelle Cerqueira;
Libório, Maxwell Santana;
Santos, Edson José da Costa;
Souto, Ulisses Borges;
de Sousa, Rômulo Ribeiro Magalhães;
Costa, Thércio Henrique de Carvalho

Publication type:

Article

Quantum-Chemical Prediction of Molecular and Electronic Structure of Carbon-Nitrogen Chemical Compound with Unusual Ratio Atoms: C(N 20).

Published in:

International Journal of Molecular Sciences, 2023, v. 24, n. 6, p. 5172, doi. 10.3390/ijms24065172

By:

Mikhailov, Oleg V.;
Chachkov, Denis V.

Publication type:

Article

Structural Manifestations of the Polarizability Effect in 1-Halogensilatranes According to the Dipole-Induced Dipole Mechanism.

Published in:

Journal of Structural Chemistry, 2019, v. 60, n. 6, p. 932, doi. 10.1134/S0022476619060076

By:

Tandura, S. N.;
Belyaeva, V. V.;
Baryshok, V. P.;
Gostevsky, B. A.;
Smirnov, V. I.

Publication type:

Article

First-Principles Study on Graphene/Mg 2 Si Interface of Selective Laser Melting Graphene/Aluminum Matrix Composites.

Published in:

Metals (2075-4701), 2021, v. 11, n. 6, p. 941, doi. 10.3390/met11060941

By:

Zhao, Zhanyong;
Chang, Shijie;
Wang, Jie;
Bai, Peikang;
Du, Wenbo;
Zhao, Wenjie

Publication type:

Article

Whole-exome sequencing expands the roles of novel mutations of organic anion transporting polypeptide, ATP-binding cassette transporter, and receptor genes in intrahepatic cholestasis of pregnancy.

Published in:

Frontiers in Genetics, 2022, v. 13, p. 1, doi. 10.3389/fgene.2022.941027

By:

Xianxian Liu;
Jiusheng Zheng;
Siming Xin;
Yang Zeng;
Xiaoying Wu;
Xiaoming Zeng;
Hua Lai;
Yang Zou

Publication type:

Article

Theoretical study of the catalytic effect of TM-C4H4 and TM-C5H5 (TM = Cr, Ti, V, Sc) on the activation of O2 at the cathode and CH3OH at the anode in "CH3OH-O2″ fuel cell via DFT computational method.

Published in:

Arabian Journal of Chemistry, 2021, v. 14, n. 4, p. N.PAG, doi. 10.1016/j.arabjc.2021.103062

By:

Nasim Rahnama, Seyedeh;
Aghaie, Mehran;
Noei, Maziar;
Aghaie, Hossein

Publication type:

Article

Bond Length Alternation Observed Experimentally: The Case of 1H‐Indazole.

Published in:

Chemistry - A European Journal, 2019, v. 25, n. 43, p. 10172, doi. 10.1002/chem.201901666

By:

Uriarte, Iciar;
Reviriego, Felipe;
Calabrese, Camilla;
Elguero, José;
Kisiel, Zbigniew;
Alkorta, Ibon;
Cocinero, Emilio J.

Publication type:

Article

Statistical Distributions of Physical Characteristics of Molecules with Casimir Force in the Transfer of Admixtures in Nanoscale Volumes.

Published in:

Journal of Applied Mathematics, 2019, p. 1, doi. 10.1155/2019/7915780

By:

Uvarova, Liudmila;
Babarin, Sergey

Publication type:

Article

POLYHEDRONS ARE VERY DIFFERENT IN PROPERTIES FROM THE BODIES OF ARCHIMEDES AND THEIR HIGH-DIMENSIONAL ANALOGS.

Published in:

Journal of Nature Science & Sustainable Technology, 2021, v. 15, n. 3, p. 97

By:

Zhizhin, Gennadiy Vladimirovich

Publication type:

Article

First‐Principles Calculations of Pressure Effects on the Structural, Electronic, Elastic, and Thermodynamic Properties of Rb2MF6 (M = Si, Ni, Pd) Crystals.

Published in:

Physica Status Solidi (B), 2022, v. 259, n. 6, p. 1, doi. 10.1002/pssb.202100607

By:

Brik, Mikhail G.;
Piasecki, Michal;
Avram, Nicolae M.

Publication type:

Article

Effect of Mg(II) and Na(I) Doping on the Electronic Structure and Mechanical Properties of Kaolinite.

Published in:

Minerals (2075-163X), 2020, v. 10, n. 4, p. 368, doi. 10.3390/min10040368

By:

Zhao, Jian;
Qin, Xinzhan;
Wang, Jiamin;
He, Manchao

Publication type:

Article

The nonlinear optical properties of AlPc-Cl organic compound using DFT and TD-DFT analysis, as well as filter optical-electrical properties.

Published in:

Journal of Nonlinear Optical Physics & Materials, 2023, v. 32, n. 4, p. 1, doi. 10.1142/S0218863523500352

By:

Benhaliliba, M.;
Ahmed, A. Ben;
Ayeshamariam, A.

Publication type:

Article

Molecular theory considering nuclear potential wells.

Published in:

Journal of Molecular Modeling, 2021, v. 27, n. 6, p. 1, doi. 10.1007/s00894-021-04804-2

By:

Zadeh, Dariush Habibollah

Publication type:

Article

Theoretical Insights into the Chemical Bonding, Electronic Structure, and Spectroscopic Properties of the Lanarkite Pb 2 SO 5 Structure.

Published in:

Physchem, 2025, v. 5, n. 2, p. 22, doi. 10.3390/physchem5020022

By:

Fabris, Guilherme S. L.;
Ferrer, Mateus M.;
Almeida, Claudio R. R.;
Paskocimas, Carlos A.;
Sambrano, Julio R.;
La Porta, Felipe A.

Publication type:

Article

Atomistic-Level Insights into MgO and Na 2 O Modifications of Molten Aluminosilicate Slag: A Molecular Dynamics Research on Structural Evolution and Properties.

Published in:

Metals (2075-4701), 2025, v. 15, n. 6, p. 656, doi. 10.3390/met15060656

By:

Jiang, Chunhe;
Liu, Bo;
Zhang, Jianliang;
Li, Kejiang

Publication type:

Article

Compositional Effects on the Tensile Behavior of Atomic Bonds in Multicomponent Cu 93−x Zr x Al 7 (at.%) Metallic Glasses.

Published in:

Molecules, 2025, v. 30, n. 12, p. 2602, doi. 10.3390/molecules30122602

By:

Thaiyanurak, Tittaya;
Gordon, Olivia;
Ye, Muyang;
Wang, Zhengming;
Xu, Donghua

Publication type:

Article

Emergence of Meron Kekulé lattices in twisted Néel antiferromagnets.

Published in:

NPJ Quantum Materials, 2025, v. 10, n. 1, p. 1, doi. 10.1038/s41535-025-00789-w

By:

Kim, Kyoung-Min;
Kim, Se Kwon

Publication type:

Article

Synthesis and Characterization of Nanocrystalline Ba-doped Mn3O4 Hausmannite Thin Films for Optoelectronic Applications.

Published in:

International Journal of Nanoscience, 2021, v. 20, n. 5, p. 1, doi. 10.1142/S0219581X2150040X

By:

Najim, Aus A.;
Gbashi, Kadhim R.;
Salih, Ammar T.

Publication type:

Article

Impact of Annealing Time on Structural Evolution of Pure and Dy3+-Doped CeO2 Nanopowder, Rietveld Refinement and Optical Behavior.

Published in:

International Journal of Nanoscience, 2021, v. 20, n. 4, p. 1, doi. 10.1142/S0219581X21500332

By:

Vats, Rajni;
Ahlawat, Rachna

Publication type:

Article

Hybrid Orbital Formation and Multicenter Bonding of Hydrogen Atoms and Molecules in Ti3C2${\rm Ti}_{3}{\rm C}_{2}$ MXenes.

Published in:

Annalen der Physik, 2024, v. 536, n. 6, p. 1, doi. 10.1002/andp.202400011

By:

Nickel, Norbert H.

Publication type:

Article

Understanding the Band Engineering in Mg2Si‐Based Systems from Wannier‐Orbital Analysis.

Published in:

Annalen der Physik, 2020, v. 532, n. 11, p. 1, doi. 10.1002/andp.201900543

By:

Tan, Xiaojian;
Yin, Yinong;
Hu, Haoyang;
Xiao, Yukun;
Guo, Zhe;
Zhang, Qiang;
Wang, Hongxiang;
Liu, Guo‐Qiang;
Jiang, Jun

Publication type:

Article

Enhancement of the Power Conversion Efficiency in Organic Photovoltaics by Unveiling the Appropriate Polymer Backbone Enlargement Approach.

Published in:

Advanced Functional Materials, 2016, v. 26, n. 11, p. 1840, doi. 10.1002/adfm.201504953

By:

Chochos, Christos L.;
Singh, Ranbir;
Kim, Min;
Gasparini, Nicola;
Katsouras, Athanasios;
Kulshreshtha, Chandramouli;
Gregoriou, Vasilis G.;
Keivanidis, Panagiotis E.;
Ameri, Tayebeh;
Brabec, Christoph J.;
Cho, Kilwon;
Avgeropoulos, Apostolos

Publication type:

Article

Syntheses of Molybdenum and Tungsten Imido Alkylidene Complexes that Contain a Bidentate Oxo/Thiolato Ligand.

Published in:

Helvetica Chimica Acta, 2020, v. 103, n. 6, p. 1, doi. 10.1002/hlca.202000068

By:

Tafazolian, Hosein;
VenkatRamani, Sudarsan;
Tsay, Charlene;
Schrock, Richard R.;
Müller, Peter

Publication type:

Article

Correlating Boron–Hydrogen Stretching Frequencies with Boron–Hydrogen Bond Lengths in Closoboranes: An Approach Using DFT Calculations.

Published in:

Helvetica Chimica Acta, 2018, v. 101, n. 2, p. 1, doi. 10.1002/hlca.201700239

By:

Hagemann, Hans;
Sharma, Manish;
Sethio, Daniel;
Lawson Daku, Latévi Max

Publication type:

Article

Authigenic Biotite from Hydrothermally Altered Terrigenous Sediments of the Central Hill (Escanaba Trough, Gorda Ridge, Pacific Ocean, ODP Hole 1038B).

Published in:

Lithology & Mineral Resources, 2024, v. 59, n. 3, p. 268, doi. 10.1134/S0024490224700548

By:

Sakharov, B. A.;
Kurnosov, V. B.;
Zaitseva, T. S.;
Savichev, A. T.;
Morozov, I. A.;
Korshunov, D. M.

Publication type:

Article

Membranes Composed of Lipopeptides and Liponucleobases Inspired Protolife Evolution.

Published in:

Origins of Life & Evolution of the Biosphere, 2019, v. 49, n. 4, p. 241, doi. 10.1007/s11084-019-09587-4

By:

Sproul, Gordon D.

Publication type:

Article

O ESPAÇO DE FORA: Experiências poético-educativas em artes visuais no espaço urbano.

Published in:

Pixo: Revista de Arquitetura Cidade e Contemporaneidade, 2022, v. 6, n. 20, p. 130, doi. 10.15210/pixo.v6i20.20890

By:

Picolo Bertinetti, Giulianna;
Susin Sirtoli, Guilherme

Publication type:

Article

CH4,N2和 CO2在煤表面的竞争吸附机理.

Published in:

Journal of Jilin University (Science Edition) / Jilin Daxue Xuebao (Lixue Ban), 2025, v. 63, n. 3, p. 943, doi. 10.13413/j.cnki.jdxblxb.2024187

By:

姜海洋

Publication type:

Article

阴阴离子调控锰基钙钛矿中 Mn─O的键长和磁性.

Published in:

Journal of Jilin University (Science Edition) / Jilin Daxue Xuebao (Lixue Ban), 2025, v. 63, n. 1, p. 151, doi. 10.13413/j.cnki.jdxblxb.2024541

By:

史文舒;
段龙辉;
刘传强;
杨化磊;
王博;
郑贝宁;
张媛;
韩梅;
冯守华

Publication type:

Article

Derivation of Relation between a parameter of Inverse correlation and effective Charge of X-ray absorbing K-Edge of Copper atom in it’s different Compounds.

Published in:

Journal of Ultra Scientist of Physical Sciences - Section B (Physics, Geology, Nano Technology Engineering, Bio Sciences, Material Science Management), 2020, v. 32, n. 5, p. 31, doi. 10.22147/jusps-B/320501

By:

RANJAN, RAKESH KUMAR

Publication type:

Article

Silver(I) coordination polymers of the ‘hinged’ pyrazine containing ligand di-2-pyrazinylmethane.

Published in:

Supramolecular Chemistry, 2015, v. 27, n. 11/12, p. 807, doi. 10.1080/10610278.2015.1078465

By:

Bloch, Witold M.;
Sumby, Christopher J.

Publication type:

Article

Bond and Cracking Characteristics of PVA-Fiber-Reinforced Cementitious Composite Reinforced with Braided AFRP Bars †.

Published in:

Fibers, 2023, v. 11, n. 12, p. 107, doi. 10.3390/fib11120107

By:

Takasago, Shugo;
Kanakubo, Toshiyuki;
Kobayashi, Hiroya;
Sasaki, Hideto

Publication type:

Article

Is There a Quadruple Fe-C Bond in FeC(CO) 3 ?

Published in:

Computation, 2021, v. 9, n. 9, p. 95, doi. 10.3390/computation9090095

By:

Nottoli, Tommaso;
Lipparini, Filippo

Publication type:

Article

All-Nitrogen Cages and Molecular Crystals: Topological Rules, Stability, and Pyrolysis Paths.

Published in:

Computation, 2020, v. 8, n. 4, p. 91, doi. 10.3390/computation8040091

By:

Katin, Konstantin P.;
Merinov, Valeriy B.;
Kochaev, Alexey I.;
Kaya, Savas;
Maslov, Mikhail M.

Publication type:

Article

Synthesis, structural and spectroscopic investigations of dolomite-type MSn(BO3)2 with M = Mn, Fe, Co and Ni.

Published in:

Zeitschrift für Kristallographie. Crystalline Materials, 2023, v. 238, n. 5/6, p. 167, doi. 10.1515/zkri-2023-0002

By:

Wittmann, Sarah;
Murshed, M. Mangir;
Bilovol, Vitaliy;
Gesing, Thorsten M.

Publication type:

Article

Halide-sodalites: thermal expansion, decomposition and the Lindemann criterion.

Published in:

Zeitschrift für Kristallographie. Crystalline Materials, 2022, v. 237, n. 1-3, p. 39, doi. 10.1515/zkri-2022-0004

By:

Wolpmann, Marius;
Robben, Lars;
Gesing, Thorsten M.

Publication type:

Article

A first principle evaluation of the adsorption mechanism and stability of volatile organic compounds into NaY zeolite.

Published in:

Zeitschrift für Kristallographie. Crystalline Materials, 2019, v. 234, n. 7/8, p. 469, doi. 10.1515/zkri-2019-0003

By:

Hessou, Etienne P.;
Jabraoui, Hicham;
Hounguè, M. T. Alice Kpota;
Mensah, Jean-Baptiste;
Pastore, Mariachiara;
Badawi, Michael

Publication type:

Article

Crystal structure refinement of MnTe2, MnSe2, and MnS2: cation-anion and anion–anion bonding distances in pyrite-type structures.

Published in:

Zeitschrift für Kristallographie. Crystalline Materials, 2019, v. 234, n. 6, p. 371, doi. 10.1515/zkri-2018-2134

By:

Tokuda, Makoto;
Yoshiasa, Akira;
Mashimo, Tsutomu;
Arima, Hiroshi;
Hongu, Hidetomo;
Tobase, Tsubasa;
Nakatsuka, Akihiko;
Sugiyama, Kazumasa

Publication type:

Article

The extended variant of the bond valence-bond length correlation curve for boron(III)-oxygen bonds.

Published in:

Zeitschrift für Kristallographie. Crystalline Materials, 2015, v. 230, n. 7, p. 495, doi. 10.1515/zkri-2015-1847

By:

Sidey, Vasyl

Publication type:

Article

Intramolecular CH‐Hydrogen Bonding During the Dissociation of the Oxaphosphetane Intermediate Facilitates Z/E‐Selectivity in Wittig Olefination.

Published in:

ChemistryOpen, 2024, v. 13, n. 3, p. 1, doi. 10.1002/open.202300171

By:

Sreenivas, Kukkamudi;
Rao, Chintada Nageswara;
Khan, Faiz Ahmed

Publication type:

Article

Protonated Ethylene Carbonate: A Highly Resonance‐Stabilized Cation.

Published in:

ChemistryOpen, 2021, v. 10, n. 12, p. 1159, doi. 10.1002/open.202100255

By:

Beck, Stefanie;
Jessen, Christoph;
Kornath, Andreas J.

Publication type:

Article