E Stereoregular 1,1 and 1,3 Constitutional Units from 1,3-Butadiene in Copolymerizations Catalyzed by a Highly Hindered C2 Symmetric Metallocene

Density-functional exchange-energy approximation with correct asymptotic behavior

Becke, A. D. (1988) · Physical Review A · doi:10.1103/physreva.38.3098 · Cited by 53,837 · see citing works

Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis

Vosko, S. H., Wilk, L., & Nusair, M. (1980) · Canadian Journal of Physics · doi:10.1139/p80-159 · Cited by 20,807 · see citing works

CHARMM: A program for macromolecular energy, minimization, and dynamics calculations

Brooks, B., Bruccoleri, R., Olafson, B. D., States, D., Swaminathan, S., & Karplus, M. (1983) · Journal of Computational Chemistry · doi:10.1002/jcc.540040211 · Cited by 13,736 · see citing works

Erratum: Density-functional approximation for the correlation energy of the inhomogeneous electron gas

Perdew, J. P. (1986) · Physical review. B, Condensed matter · doi:10.1103/physrevb.34.7406 · Cited by 2,782 · see citing works

Numerical integration for polyatomic systems

Velde, G. T., & Baerends, E. J. (1992) · Journal of Computational Physics · doi:10.1016/0021-9991(92)90277-6 · Cited by 1,798 · see citing works

IMOMM: A new integrated ab initio + molecular mechanics geometry optimization scheme of equilibrium structures and transition states

Maseras, F., & Morokuma, K. (1995) · Journal of Computational Chemistry · doi:10.1002/jcc.540160911 · Cited by 1,726 · see citing works

Microstructure of isotactic polypropylene prepared with homogeneous catalysis: stereoregularity, regioregularity, and 1,3 insertion

Grassi, A., Zambelli, A., Resconi, L., et al. (1988) · Macromolecules · doi:10.1021/ma00181a012 · Cited by 225 · see citing works

A Density Functional Study of the Mechanism of the Diimine−Nickel-Catalyzed Ethylene Polymerization Reaction

Musaev, D. G., Froese, R. D. J., Svensson, M., et al. (1997) · Journal of the American Chemical Society · doi:10.1021/ja9628314 · Cited by 187 · see citing works

Stereo‐ and Regioselectivity of Chiral, Alkyl‐substituted ansa‐Zirconocene Catalysts in Methylalumoxane‐activated Propene Polymerization

Röll, W., Brintzinger, H., Rieger, B., et al. (1990) · Angewandte Chemie International Edition in English · doi:10.1002/anie.199002791 · Cited by 186 · see citing works

Highly Regiospecific Zirconocene Catalysts for the Isospecific Polymerization of Propene

Resconi, L., Piemontesi, F., Camurati, I., Sudmeijer, O., Nifant'ev, I. E., Ivchenko, P. V., & Kuzmina, L. G. (1998) · Journal of the American Chemical Society · doi:10.1021/ja973160s · Cited by 182 · see citing works

Hydrogenation of unsaturated polymers with diimide

Mango, L. A., & Lenz, R. W. (1973) · Die Makromolekulare Chemie · doi:10.1002/macp.1973.021630102 · Cited by 168 · see citing works

Implementation of the IMOMM methodology for performing combined QM/MM molecular dynamics simulations and frequency calculations

Woo, T. K., Cavallo, L., & Ziegler, T. (1998) · Theoretical Chemistry Accounts · doi:10.1007/s002140050391 · Cited by 147 · see citing works

C13 and H1 Nuclear Magnetic Resonance Spectra of Cycloalkanes

BURKE, J. J., & Lauterbur, P. C. (1964) · Journal of the American Chemical Society · doi:10.1021/ja01063a055 · Cited by 142 · see citing works

A Unified View of Ethylene Polymerization by d0 and d0fn Transition Metals. 1. Precursor Compounds and Olefin Uptake Energetics

Margl, P. M., Deng, L., & Ziegler, T. (1998) · Organometallics · doi:10.1021/om9707578 · Cited by 125 · see citing works

Carbon-13 enriched end groups of isotactic polypropylene and poly(1-butene) prepared in the presence of ethylenediindenyldimethyltitanium and methylalumoxane

Longo, P., Grassi, A., Pellecchia, C., et al. (1987) · Macromolecules · doi:10.1021/ma00171a023 · Cited by 124 · see citing works

Data book on hydrocarbons

Rossini, F. D. (1950) · Journal of Chemical Education · doi:10.1021/ed027p412.1 · Cited by 113 · see citing works

Correlation of carbon-13 and nitrogen-15 chemical shifts in selectively and uniformly labeled proteins by heteronuclear two-dimensional NMR spectroscopy

Westler, W. M., Stockman, B. J., Hosoya, Y., et al. (1988) · Journal of the American Chemical Society · doi:10.1021/ja00226a057 · Cited by 110 · see citing works

Diimide as a reagent for the hydrogenation of unsaturated polymers

Harwood, H. J., Russell, D. B., Verthe, J. J. A., et al. (1973) · Die Makromolekulare Chemie · doi:10.1002/macp.1973.021630101 · Cited by 107 · see citing works

rac-[Methylene(3-tert-butyl-1-indenyl)2]ZrCl2: A Simple, High-Performance Zirconocene Catalyst for Isotactic Polypropene

Resconi, L., Balboni, D., Baruzzi, G., Fiori, C., Guidotti, S., Mercandelli, P., & Sironi, A. (2000) · Organometallics · doi:10.1021/om990487o · Cited by 106 · see citing works

Relationship between Regiospecificity and Type of Stereospecificity in Propene Polymerization with Zirconocene-Based Catalysts1

Guerra, G., Longo, P., Cavallo, L., et al. (1997) · Journal of the American Chemical Society · doi:10.1021/ja964142y · Cited by 105 · see citing works

Stereoselective Cyclopropanation by Cyclocopolymerization of Butadiene

Pragliola, S., Milano, G., Guerra, G., & Longo, P. (2002) · Journal of the American Chemical Society · doi:10.1021/ja017416c · Cited by 61 · see citing works

¹³C NMR analysis of α‐olefins copolymers with 1,3‐butadiene obtained with zirconocenes/methylalumoxane catalysts

Galimberti, M., Albizzati, E., Abis, L., & Bacchilega, G. (1991) · Die Makromolekulare Chemie · doi:10.1002/macp.1991.021921106 · Cited by 57 · see citing works

Influence of π-Ligand Substitutions on the Regiospecificity and Stereospecificity in Isospecific Zirconocenes for Propene Polymerization. A Molecular Mechanics Analysis

Toto, M., Cavallo, L., Corradini, P., Moscardi, G., Resconi, L., & Guerra, G. (1998) · Macromolecules · doi:10.1021/ma980238w · Cited by 56 · see citing works

Stereospecific Ethylene−Styrene Block Copolymerization with ansa-Zirconocene-Based Catalyst†

Caporaso, L., Izzo, L., Sisti, I., et al. (2002) · Macromolecules · doi:10.1021/ma011489z · Cited by 48 · see citing works

Molecular Mechanics Force Fields for Bent Metallocenes of the Type [M(Cp)2Cl2]

Doman, T. N., Hollis, T. K., & Bosnich, B. (1995) · Journal of the American Chemical Society · doi:10.1021/ja00109a020 · Cited by 48 · see citing works

Absolute configurations, maximum rotations, and kinetics of thermal racemization of the 1-phenyl-2-deuteriocyclopropanes

Baldwin, J. E., & Barden, T. C. (1984) · Journal of the American Chemical Society · doi:10.1021/ja00333a042 · Cited by 38 · see citing works

Etude structurale du polypentadiene‐1,3 par spectrometrie de RMN du 13C

Aubert, P., Sledz, J., Schué, F., & Brevard, C. (1981) · Journal of Polymer Science Polymer Chemistry Edition · doi:10.1002/pol.1981.170190410 · Cited by 36 · see citing works

Nuclear Magnetic Resonance Studies of Hydrogen Bonding. II. Calculation of the Shift upon Complex Formation

Berkeley, P. J., & Hanna, M. W. (1964) · Journal of the American Chemical Society · doi:10.1021/ja01069a005 · Cited by 36 · see citing works

A combined QM/MM study of ligand substitution enthalpies in the L2Fe(CO)3, RuCpL2Cl, and RuCp*L2Cl systems

Cavallo, L., Woo, T. K., & Ziegler, T. (1998) · Canadian Journal of Chemistry · doi:10.1139/v98-169 · Cited by 29 · see citing works

Polymerization of 1,3-pentadiene by cobalt catalysts. Synthesis of 1,2 and CIS-1,4 syndiotactic polypentadienes

Porri, L., Corato, A. D., & Natta, G. (1969) · European Polymer Journal · doi:10.1016/0014-3057(69)90097-4 · Cited by 29 · see citing works

Aliphatic Dienyl Cations

Deno, N. C., & Pittman, C. U. J. (1964) · Journal of the American Chemical Society · doi:10.1021/ja01063a056 · Cited by 25 · see citing works

Crystal structure of isotactic trans-1,4-poly(1,3-pentadiene): an analysis by conformational and packing energy calculations

Napolitano, R. (1988) · Macromolecules · doi:10.1021/ma00181a013 · Cited by 14 · see citing works

Carbon-13 NMR spectra of methyl-substituted 1,4-trans-polybutadienes. 2. Spectra of several copolymers

Sozzani, P., Silvestro, G. D., Grassi, M., et al. (1984) · Macromolecules · doi:10.1021/ma00142a013 · Cited by 11 · see citing works

Eine colorimetrische Methode zur Bestimmung des Acetylens

Schulze, A. (1916) · Angewandte Chemie · doi:10.1002/ange.19160297104 · Cited by 5 · see citing works

<i>cis</i>‐1,4‐Selective Copolymerization of Ethylene and Butadiene: A Compromise between Two Mechanisms

Wu, C., Liu, B., Lin, F., Wang, M., & Cui, D. (2017) · Angewandte Chemie International Edition · doi:10.1002/anie.201702128 · Cited by 67 · see citing works

Ethylene−Butadiene Copolymerization Promoted by Titanium Complex Containing a Tetradentate [OSSO]-Type Bis(phenolato) Ligand

Capacchione, C., Avagliano, A., & Proto, A. (2008) · Macromolecules · doi:10.1021/ma800864y · Cited by 51 · see citing works

<i>ansa</i>-Bis(fluorenyl)neodymium Catalysts for Cyclocopolymerization of Ethylene with Butadiene

Thuilliez, J., Ricard, L., Nief, F., Boisson, F., & Boisson, C. (2009) · Macromolecules · doi:10.1021/ma9003852 · Cited by 51 · see citing works

Heterogenized “Ligand-Free” Lanthanide Catalysts for the Homo- and Copolymerization of Ethylene and 1,3-Butadiene

Woodman, T. J., Sarazin, Y., Fink, G., Hauschild, K., & Bochmann, M. (2005) · Macromolecules · doi:10.1021/ma047454r · Cited by 50 · see citing works

Butadiene Insertion and Constitutional Units in Ethene Copolymerizations by <i>C</i>₂-Symmetric Metallocenes

Longo, P., Napoli, M., Pragliola, S., Costabile, C., Milano, G., & Guerra, G. (2003) · Macromolecules · doi:10.1021/ma034830j · Cited by 47 · see citing works

Installing a Trigger to Upcycle High-Density Polyethylene

Nan, T., Chen, Q., Zheng, Z., Liang, Y., Qin, Y., Wang, Y., Liu, B., & Cui, D. (2024) · Journal of the American Chemical Society · doi:10.1021/jacs.4c08958 · Cited by 42 · see citing works

New Group IV Metallocene Systems Active in the Copolymerization of <i>α</i>‐Olefins and Conjugated Dienes

Napoli, M., Pragliola, S., Costabile, C., & Longo, P. (2006) · Macromolecular Chemistry and Physics · doi:10.1002/macp.200500457 · Cited by 16 · see citing works

Ethylene-1,2-cyclopentane random copolymers from cyclocopolymerization of ethylene/1,3-butadiene

Pragliola, S., Cavallo, G., Longo, P., & Venditto, V. (2013) · Polymer · doi:10.1016/j.polymer.2013.05.059 · Cited by 16 · see citing works

Wadsworth Emmons cyclopropanation mediated diastereoselective Syntheses of α-epoxy- trans-disubstituted cyclopropane and α-hydroxy-trans-disubstituted cyclopropane

Ramakrishna, D. S. (2021) · Chemical Data Collections · doi:10.1016/j.cdc.2021.100667 · Cited by 9 · see citing works

Direct synthesis of per(poly)fluoroalkylmethyl‐substituted electrophilic cyclopropane derivatives

Chen, J., & Hu, C. (1995) · Chinese Journal of Chemistry · doi:10.1002/cjoc.19950130413 · Cited by 2 · see citing works

Preparation of Optically Active cis-Cyclopropane Carboxylates: Cyclopropanation of α-Silyl Stryenes with Aryldiazoacetates and Desilylation of the Resulting Silyl Cyclopropanes

Su, Y., Li, Q., Zhao, Y., et al. (2016) · Organic Letters · doi:10.1021/acs.orglett.6b02117 · Cited by 29 · see citing works

trans-Directing Ability of the Amide Group: Enabling the Enantiocontrol in the Synthesis of 1,1-Dicarboxy Cyclopropanes. Reaction Development, Scope, and Synthetic Applications

Marcoux, D., Goudreau, S. R., & Charette, A. B. (2009) · The Journal of Organic Chemistry · doi:10.1021/jo902066y · Cited by 76 · see citing works

Ru(II)–Pheox-Catalyzed Asymmetric Intramolecular Cyclopropanation of Electron-Deficient Olefins

Nakagawa, Y., Chanthamath, S., Shibatomi, K., et al. (2015) · Organic Letters · doi:10.1021/acs.orglett.5b01201 · Cited by 43 · see citing works