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	1.	Assessment of the CCSD and CCSD(T) Coupled-Cluster Methods in Calculating Heats of Formation for Cu Complexes. [electronic resource] by Weaver, Michael N Merz, Kenneth M Publication details: Molecular physics Jan 2009 In: Molecular physics vol. 107 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Assessment of the CCSD and CCSD(T) coupled-cluster methods in calculating heats of formation for Zn complexes. [electronic resource] by Weaver, Michael N Yang, Yue Merz, Kenneth M Producer: 20100108 In: The journal of physical chemistry. A vol. 113 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Assessment of the "6-31+G** + LANL2DZ" mixed basis set coupled with density functional theory methods and the effective core potential: prediction of heats of formation and ionization potentials for first-row-transition-metal complexes. [electronic resource] by Yang, Yue Weaver, Michael N Merz, Kenneth M Producer: 20091117 In: The journal of physical chemistry. A vol. 113 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Effect of 10.5 M Aqueous Urea on Helicobacter pylori Urease: A Molecular Dynamics Study. [electronic resource] by Minkara, Mona S Weaver, Michael N Merz, Kenneth M Producer: 20150929 In: Biochemistry vol. 54 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	Solvent control of charge localization in 11-bond bridged dinitroaromatic radical anions. [electronic resource] by Nelsen, Stephen F Weaver, Michael N Telo, João P Producer: 20070626 In: Journal of the American Chemical Society vol. 129 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	Charge localization in a 17-bond mixed-valence quinone radical anion. [electronic resource] by Nelsen, Stephen F Weaver, Michael N Telo, João P Producer: 20071221 In: The journal of physical chemistry. A vol. 111 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	Molecular Dynamics Study of [electronic resource] by Minkara, Mona S Ucisik, Melek N Weaver, Michael N Merz, Kenneth M Publication details: Journal of chemical theory and computation May 2014 In: Journal of chemical theory and computation vol. 10 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	Optical spectra of delocalized dinitroaromatic radical anions revisited. [electronic resource] by Nelsen, Stephen F Weaver, Michael N Zink, Jeffrey I Telo, João P Producer: 20050929 In: Journal of the American Chemical Society vol. 127 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	Intervalence near-IR spectra of delocalized dinitroaromatic radical anions. [electronic resource] by Nelsen, Stephen F Konradsson, Asgeir E Weaver, Michael N Telo, João P Producer: 20031215 In: Journal of the American Chemical Society vol. 125 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	Calculation of Heats of Formation for Zn Complexes: Comparison of Density Functional Theory, Second Order Perturbation Theory, Coupled-Cluster and Complete Active Space Methods. [electronic resource] by Weaver, Michael N Merz, Kenneth M Ma, Dongxia Kim, Hyun Jung Gagliardi, Laura Publication details: Journal of chemical theory and computation Dec 2013 In: Journal of chemical theory and computation vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	Resonance Raman de-enhancement caused by excited state mixed valence. [electronic resource] by Wang, Xianghuai Valverde-Aguilar, Guadalupe Weaver, Michael N Nelsen, Stephen F Zink, Jeffrey I Producer: 20070827 In: The journal of physical chemistry. A vol. 111 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	Calculations of the optical spectra of hydrocarbon radical cations based on Koopmans' theorem. [electronic resource] by Nelsen, Stephen F Weaver, Michael N Yamazaki, Daisuke Komatsu, Koichi Rathore, Rajendra Bally, Thomas Producer: 20070509 In: The journal of physical chemistry. A vol. 111 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	Implementation of Protocols To Enable Doctoral Training in Physical and Computational Chemistry of a Blind Graduate Student. [electronic resource] by Minkara, Mona S Weaver, Michael N Gorske, Jim Bowers, Clifford R Merz, Kenneth M Publication details: Journal of chemical education Aug 2015 In: Journal of chemical education vol. 92 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	Koopmans-based analysis of the optical spectra of p-phenylene-bridged intervalence radical ions. [electronic resource] by Nelsen, Stephen F Weaver, Michael N Telo, João P Lucht, Brett L Barlow, Stephen Producer: 20060620 In: The Journal of organic chemistry vol. 70 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	Electron transfer within 2,7-dinitronaphthalene radical anion. [electronic resource] by Nelsen, Stephen F Weaver, Michael N Konradsson, Asgeir E Telo, João P Clark, Timothy Producer: 20050502 In: Journal of the American Chemical Society vol. 126 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Optical spectra of protected diamine 10-bond-bridged intervalence radical cations related to N,N,N'N'-tetraalkylbenzidine. [electronic resource] by Nelsen, Stephen F Luo, Yun Weaver, Michael N Lockard, Jenny V Zink, Jeffrey I Producer: 20070611 In: The Journal of organic chemistry vol. 71 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	17.	Three-chromophore excited-state mixed valence. [electronic resource] by Hoekstra, Ryan M Dibrell, Marcelle M Weaver, Michael N Nelsen, Stephen F Zink, Jeffrey I Producer: 20090310 In: The journal of physical chemistry. A vol. 113 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	18.	Spectroscopic consequences of a mixed valence excited state: quantitative treatment of a dihydrazine diradical dication. [electronic resource] by Lockard, Jenny V Zink, Jeffrey I Konradsson, Asgeir E Weaver, Michael N Nelsen, Stephen F Producer: 20040226 In: Journal of the American Chemical Society vol. 125 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	19.	Structural Survey of Zinc Containing Proteins and the Development of the Zinc AMBER Force Field (ZAFF). [electronic resource] by Peters, Martin B Yang, Yue Wang, Bing Füsti-Molnár, László Weaver, Michael N Merz, Kenneth M Publication details: Journal of chemical theory and computation Sep 2010 In: Journal of chemical theory and computation vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	20.	Interpretation of unusual absorption bandwidths and resonance Raman intensities in excited state mixed valence. [electronic resource] by Lockard, Jenny V Valverde, Guadalupe Neuhauser, Daniel Zink, Jeffrey I Luo, Yun Weaver, Michael N Nelsen, Stephen F Producer: 20070801 In: The journal of physical chemistry. A vol. 110 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)

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Your search returned 26 results.