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Charles Bruce Musgrave

TitleProfessor
InstitutionUniversity of Colorado Boulder
DepartmentChemical & Biological Engin
Phone303/735-0411
    Other Positions
    TitleEndowed or Named Professor
    InstitutionUniversity of Colorado Boulder
    DepartmentCollege Engineering & App Sci


    Collapse Bibliographic 
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    Publications listed below are automatically derived from MEDLINE/PubMed and other sources, which might result in incorrect or missing publications. Faculty can login to make corrections and additions.
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    1. Bennett MT, Jia X, Musgrave CB, Zhu W, Goddard WA, Gunnoe TB. Pd(II) and Rh(I) Catalytic Precursors for Arene Alkenylation: Comparative Evaluation of Reactivity and Mechanism Based on Experimental and Computational Studies. J Am Chem Soc. 2023 Jul 19; 145(28):15507-15527. PMID: 37392467.
      View in: PubMed
    2. Bare ZJL, Morelock RJ, Musgrave CB. Dataset of theoretical multinary perovskite oxides. Sci Data. 2023 04 28; 10(1):244. PMID: 37117319.
      View in: PubMed
    3. Zoric MR, Chan T, Musgrave CB, Goddard WA, Kubiak CP, Cordones AA. In situ x-ray absorption investigations of a heterogenized molecular catalyst and its interaction with a carbon nanotube support. J Chem Phys. 2023 Feb 21; 158(7):074703. PMID: 36813711.
      View in: PubMed
    4. Hyler FP, Wuille Bille BA, Ort?z-Rodr?guez JC, Sanz-Matias A, Roychoudhury S, Perryman JT, Patridge CJ, Singstock NR, Musgrave CB, Prendergast D, Vel?zquez JM. X-ray absorption spectroscopy insights on the structure anisotropy and charge transfer in Chevrel Phase chalcogenides. Phys Chem Chem Phys. 2022 Jul 21; 24(28):17289-17294. PMID: 35815404.
      View in: PubMed
    5. Singstock NR, Musgrave CB. How the Bioinspired Fe2Mo6S8 Chevrel Breaks Electrocatalytic Nitrogen Reduction Scaling Relations. J Am Chem Soc. 2022 07 20; 144(28):12800-12806. PMID: 35816127.
      View in: PubMed
    6. Morelock RJ, Bare ZJL, Musgrave CB. Bond-Valence Parameterization for the Accurate Description of DFT Energetics. J Chem Theory Comput. 2022 May 10; 18(5):3257-3267. PMID: 35442669.
      View in: PubMed
    7. Petersen HA, Alherz AW, Stinson TA, Huntzinger CG, Musgrave CB, Luca OR. Predictive energetic tuning of C-Nucleophiles for the electrochemical capture of carbon dioxide. iScience. 2022 Apr 15; 25(4):103997. PMID: 35310940.
      View in: PubMed
    8. Yan E, Balgley R, Morla MB, Kwon S, Musgrave CB, Brunschwig BS, Goddard WA, Lewis NS. Experimental and Theoretical Comparison of Potential-dependent Methylation on Chemically Exfoliated WS2 and MoS2. ACS Appl Mater Interfaces. 2022 Feb 23; 14(7):9744-9753. PMID: 35147404.
      View in: PubMed
    9. Calvinho KUD, Alherz AW, Yap KMK, Laursen AB, Hwang S, Bare ZJL, Clifford Z, Musgrave CB, Dismukes GC. Surface Hydrides on Fe2P Electrocatalyst Reduce CO2 at Low Overpotential: Steering Selectivity to Ethylene Glycol. J Am Chem Soc. 2021 12 22; 143(50):21275-21285. PMID: 34882386.
      View in: PubMed
    10. Kim K, Mascarenas A, Musgrave CB, Stansbury JW. Relocation and reinforcement of the adhesive/composite interface with spontaneous amine-peroxide interfacial polymerization. Dent Mater. 2021 12; 37(12):1865-1872. PMID: 34627632.
      View in: PubMed
    11. Kim K, Sinha J, Stansbury JW, Musgrave CB. Visible-Light Photoinitiation of (Meth)acrylate Polymerization with Autonomous Post-conversion. Macromolecules. 2021 Sep 14; 54(17):7702-7715. PMID: 35938043.
      View in: PubMed
    12. Alkhater MF, Alherz AW, Musgrave CB. Diazaphospholenes as reducing agents: a thermodynamic and electrochemical DFT study. Phys Chem Chem Phys. 2021 Sep 07; 23(33):17794-17802. PMID: 34382635.
      View in: PubMed
    13. Gu AY, Musgrave C, Goddard WA, Hoffmann MR, Colussi AJ. Role of Ferryl Ion Intermediates in Fast Fenton Chemistry on Aqueous Microdroplets. Environ Sci Technol. 2021 11 02; 55(21):14370-14377. PMID: 34213313.
      View in: PubMed
    14. Singstock NR, Ortiz-Rodr?guez JC, Perryman JT, Sutton C, Vel?zquez JM, Musgrave CB. Machine Learning Guided Synthesis of Multinary Chevrel Phase Chalcogenides. J Am Chem Soc. 2021 Jun 23; 143(24):9113-9122. PMID: 34107683.
      View in: PubMed
    15. Huang S, Kim K, Musgrave GM, Sharp M, Sinha J, Stansbury JW, Musgrave CB, Bowman CN. Determining Michael Acceptor Reactivity from Kinetic, Mechanistic, and Computational Analysis for the Base-catalyzed Thiol-Michael Reaction. Polym Chem. 2021 Jul 07; 12(25):3619-3628. PMID: 34484433.
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    16. Weerasooriya RB, Gesiorski JL, Alherz A, Ilic S, Hargenrader GN, Musgrave CB, Glusac KD. Kinetics of Hydride Transfer from Catalytic Metal-Free Hydride Donors to CO2. J Phys Chem Lett. 2021 Mar 11; 12(9):2306-2311. PMID: 33651629.
      View in: PubMed
    17. Musgrave CB, Morozov S, Schinski WL, Goddard WA. Reduction of N2 to Ammonia by Phosphate Molten Salt and Li Electrode: Proof of Concept Using Quantum Mechanics. J Phys Chem Lett. 2021 Feb 18; 12(6):1696-1701. PMID: 33560856.
      View in: PubMed
    18. Musgrave CB, Kim K, Singstock NR, Salazar AM, Stansbury JW, Musgrave CB. Computational and Experimental Evaluation of Peroxide Oxidants for Amine-Peroxide Redox Polymerization. Macromolecules. 2020 Nov 24; 53(22):9736-9746. PMID: 35983372.
      View in: PubMed
    19. Clary JM, Holder AM, Musgrave CB. Computationally Predicted High-Throughput Free-Energy Phase Diagrams for the Discovery of Solid-State Hydrogen Storage Reactions. ACS Appl Mater Interfaces. 2020 Oct 28; 12(43):48553-48564. PMID: 33074642.
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    20. Bartel CJ, Clary JM, Sutton C, Vigil-Fowler D, Goldsmith BR, Holder AM, Musgrave CB. Correction to "Inorganic Halide Double Perovskites with Optoelectronic Properties Modulated by Sublattice Mixing". J Am Chem Soc. 2020 Oct 07; 142(40):17206-17207. PMID: 32961054.
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    21. Trottier RM, Millican SL, Musgrave CB. Modified Single Iteration Synchronous-Transit Approach to Bound Diffusion Barriers for Solid-State Reactions. J Chem Theory Comput. 2020 Sep 08; 16(9):5912-5922. PMID: 32786903.
      View in: PubMed
    22. Ortiz-Rodr?guez JC, Singstock NR, Perryman JT, Hyler FP, Jones SJ, Holder AM, Musgrave CB, Vel?zquez JM. Stabilizing Hydrogen Adsorption through Theory-Guided Chalcogen Substitution in Chevrel-Phase Mo6X8 (X=S, Se, Te) Electrocatalysts. ACS Appl Mater Interfaces. 2020 Aug 12; 12(32):35995-36003. PMID: 32667188.
      View in: PubMed
    23. Trottier RM, Bare ZJL, Millican SL, Musgrave CB. Predicting Spinel Disorder and Its Effect on Oxygen Transport Kinetics in Hercynite. ACS Appl Mater Interfaces. 2020 May 27; 12(21):23831-23843. PMID: 32364703.
      View in: PubMed
    24. Bartel CJ, Clary JM, Sutton C, Vigil-Fowler D, Goldsmith BR, Holder AM, Musgrave CB. Inorganic Halide Double Perovskites with Optoelectronic Properties Modulated by Sublattice Mixing. J Am Chem Soc. 2020 Mar 18; 142(11):5135-5145. PMID: 32088953.
      View in: PubMed
    25. Myren THT, Alherz A, Stinson TA, Huntzinger CG, Lama B, Musgrave CB, Luca OR. Metalloradical intermediates in electrocatalytic reduction of CO2 to CO: Mn versus Re bis-N-heterocyclic carbene pincers. Dalton Trans. 2020 Feb 21; 49(7):2053-2057. PMID: 31971534.
      View in: PubMed
    26. Clary JM, Van Norman SA, Funke HH, Su D, Musgrave CB, Weimer AW. Highly dispersed Co deposited on Al2O3 particles via CoCp2?+?H2 ALD. Nanotechnology. 2020 Apr 24; 31(17):175703. PMID: 31913142.
      View in: PubMed
    27. Jenkins AH, Musgrave CB, Medlin JW. Enhancing Au/TiO2 Catalyst Thermostability and Coking Resistance with Alkyl Phosphonic-Acid Self-Assembled Monolayers. ACS Appl Mater Interfaces. 2019 Nov 06; 11(44):41289-41296. PMID: 31618571.
      View in: PubMed
    28. Love D, Kim K, Domaille DW, Williams O, Stansbury J, Musgrave C, Bowman C. Catalyst-free, aza-Michael polymerization of hydrazides: polymerizability, kinetics, and mechanistic origin of an a-effect. Polym Chem. 2019 Nov 14; 10(42):5790-5804. PMID: 31749894.
      View in: PubMed
    29. Ilic S, Alherz A, Musgrave CB, Glusac KD. Importance of proton-coupled electron transfer in cathodic regeneration of organic hydrides. Chem Commun (Camb). 2019 May 09; 55(39):5583-5586. PMID: 31020295.
      View in: PubMed
    30. Kim K, Singstock NR, Childress KK, Sinha J, Salazar AM, Whitfield SN, Holder AM, Stansbury JW, Musgrave CB. Rational Design of Efficient Amine Reductant Initiators for Amine-Peroxide Redox Polymerization. J Am Chem Soc. 2019 04 17; 141(15):6279-6291. PMID: 30915845.
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    31. Bartel CJ, Rumptz JR, Weimer AW, Holder AM, Musgrave CB. High-Throughput Equilibrium Analysis of Active Materials for Solar Thermochemical Ammonia Synthesis. ACS Appl Mater Interfaces. 2019 Jul 17; 11(28):24850-24858. PMID: 30920791.
      View in: PubMed
    32. Bartel CJ, Sutton C, Goldsmith BR, Ouyang R, Musgrave CB, Ghiringhelli LM, Scheffler M. New tolerance factor to predict the stability of perovskite oxides and halides. Sci Adv. 2019 Feb; 5(2):eaav0693. PMID: 30783625.
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    33. Lim CH, Ilic S, Alherz A, Worrell BT, Bacon SS, Hynes JT, Glusac KD, Musgrave CB. Benzimidazoles as Metal-Free and Recyclable Hydrides for CO2 Reduction to Formate. J Am Chem Soc. 2019 01 09; 141(1):272-280. PMID: 30477302.
      View in: PubMed
    34. Alherz A, Lim CH, Kuo YC, Lehman P, Cha J, Hynes JT, Musgrave CB. Renewable Hydride Donors for the Catalytic Reduction of CO2: A Thermodynamic and Kinetic Study. J Phys Chem B. 2018 Nov 08; 122(44):10179-10189. PMID: 30290115.
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    35. Mavila S, Worrell BT, Culver HR, Goldman TM, Wang C, Lim CH, Domaille DW, Pattanayak S, McBride MK, Musgrave CB, Bowman CN. Dynamic and Responsive DNA-like Polymers. J Am Chem Soc. 2018 10 24; 140(42):13594-13598. PMID: 30351134.
      View in: PubMed
    36. Bartel CJ, Millican SL, Deml AM, Rumptz JR, Tumas W, Weimer AW, Lany S, Stevanovic V, Musgrave CB, Holder AM. Physical descriptor for the Gibbs energy of inorganic crystalline solids and temperature-dependent materials chemistry. Nat Commun. 2018 10 09; 9(1):4168. PMID: 30301890.
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    37. Worrell BT, McBride MK, Lyon GB, Cox LM, Wang C, Mavila S, Lim CH, Coley HM, Musgrave CB, Ding Y, Bowman CN. Publisher Correction: Bistable and photoswitchable states of matter. Nat Commun. 2018 08 07; 9(1):3204. PMID: 30087353.
      View in: PubMed
    38. Worrell BT, McBride MK, Lyon GB, Cox LM, Wang C, Mavila S, Lim CH, Coley HM, Musgrave CB, Ding Y, Bowman CN. Bistable and photoswitchable states of matter. Nat Commun. 2018 07 18; 9(1):2804. PMID: 30022053.
      View in: PubMed
    39. Ilic S, Alherz A, Musgrave CB, Glusac KD. Thermodynamic and kinetic hydricities of metal-free hydrides. Chem Soc Rev. 2018 Apr 23; 47(8):2809-2836. PMID: 29543931.
      View in: PubMed
    40. Love DM, Kim K, Goodrich JT, Fairbanks BD, Worrell BT, Stoykovich MP, Musgrave CB, Bowman CN. Amine Induced Retardation of the Radical-Mediated Thiol-Ene Reaction via the Formation of Metastable Disulfide Radical Anions. J Org Chem. 2018 03 02; 83(5):2912-2919. PMID: 29390175.
      View in: PubMed
    41. Alherz A, Lim CH, Hynes JT, Musgrave CB. Predicting Hydride Donor Strength via Quantum Chemical Calculations of Hydride Transfer Activation Free Energy. J Phys Chem B. 2018 01 25; 122(3):1278-1288. PMID: 29251933.
      View in: PubMed
    42. Lim CH, Holder AM, Hynes JT, Musgrave CB. Dihydropteridine/Pteridine as a 2H+/2e- Redox Mediator for the Reduction of CO2 to Methanol: A Computational Study. J Phys Chem B. 2017 04 27; 121(16):4158-4167. PMID: 28375636.
      View in: PubMed
    43. Ryan MD, Theriot JC, Lim CH, Yang H, Lockwood A, Garrison NG, Lincoln SR, Musgrave CB, Miyake GM. Solvent Effects on the Intramolecular Charge Transfer Character of N,N-Diaryl Dihydrophenazine Catalysts for Organocatalyzed Atom Transfer Radical Polymerization. J Polym Sci A Polym Chem. 2017 Sep 15; 55(18):3017-3027. PMID: 28966439.
      View in: PubMed
    44. Alghannam A, Muhich CL, Musgrave CB. Adatom surface diffusion of catalytic metals on the anatase TiO2(101) surface. Phys Chem Chem Phys. 2017 Feb 08; 19(6):4541-4552. PMID: 28124047.
      View in: PubMed
    45. Lim CH, Ryan MD, McCarthy BG, Theriot JC, Sartor SM, Damrauer NH, Musgrave CB, Miyake GM. Intramolecular Charge Transfer and Ion Pairing in N,N-Diaryl Dihydrophenazine Photoredox Catalysts for Efficient Organocatalyzed Atom Transfer Radical Polymerization. J Am Chem Soc. 2017 01 11; 139(1):348-355. PMID: 27973788.
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    46. Tebbe JL, Fuerst TF, Musgrave CB. Degradation of Ethylene Carbonate Electrolytes of Lithium Ion Batteries via Ring Opening Activated by LiCoO2 Cathode Surfaces and Electrolyte Species. ACS Appl Mater Interfaces. 2016 Oct 12; 8(40):26664-26674. PMID: 27610630.
      View in: PubMed
    47. Pearson RM, Lim CH, McCarthy BG, Musgrave CB, Miyake GM. Organocatalyzed Atom Transfer Radical Polymerization Using N-Aryl Phenoxazines as Photoredox Catalysts. J Am Chem Soc. 2016 09 07; 138(35):11399-407. PMID: 27554292.
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    48. Young MJ, Hare CD, Cavanagh AS, Musgrave CB, George SM. Rapid Growth of Crystalline Mn5O8 by Self-Limited Multilayer Deposition using Mn(EtCp)2 and O3. ACS Appl Mater Interfaces. 2016 Jul 20; 8(28):18560-9. PMID: 27351207.
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    49. Bartel CJ, Muhich CL, Weimer AW, Musgrave CB. Aluminum Nitride Hydrolysis Enabled by Hydroxyl-Mediated Surface Proton Hopping. ACS Appl Mater Interfaces. 2016 Jul 20; 8(28):18550-9. PMID: 27341277.
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    50. Theriot JC, Lim CH, Yang H, Ryan MD, Musgrave CB, Miyake GM. Organocatalyzed atom transfer radical polymerization driven by visible light. Science. 2016 May 27; 352(6289):1082-6. PMID: 27033549.
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    51. Lim CH, Holder AM, Hynes JT, Musgrave CB. Catalytic Reduction of CO2 by Renewable Organohydrides. J Phys Chem Lett. 2015 Dec 17; 6(24):5078-92. PMID: 26722706.
      View in: PubMed
    52. Tebbe JL, Holder AM, Musgrave CB. Mechanisms of LiCoO2 Cathode Degradation by Reaction with HF and Protection by Thin Oxide Coatings. ACS Appl Mater Interfaces. 2015 Nov 04; 7(43):24265-78. PMID: 26455367.
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    53. Muhich CL, Qiu J, Holder AM, Wu YC, Weimer AW, Wei WD, McElwee-White L, Musgrave CB. Solvent Control of Surface Plasmon-Mediated Chemical Deposition of Au Nanoparticles from Alkylgold Phosphine Complexes. ACS Appl Mater Interfaces. 2015 Jun 24; 7(24):13384-94. PMID: 26036274.
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    54. Young MJ, Musgrave CB, George SM. Growth and Characterization of Al2O3 Atomic Layer Deposition Films on sp(2)-Graphitic Carbon Substrates Using NO2/Trimethylaluminum Pretreatment. ACS Appl Mater Interfaces. 2015 Jun 10; 7(22):12030-7. PMID: 25965097.
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    55. Deml AM, Holder AM, O'Hayre RP, Musgrave CB, Stevanovic V. Intrinsic Material Properties Dictating Oxygen Vacancy Formation Energetics in Metal Oxides. J Phys Chem Lett. 2015 May 21; 6(10):1948-53. PMID: 26263275.
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    56. Lim CH, Holder AM, Hynes JT, Musgrave CB. Reduction of CO2 to methanol catalyzed by a biomimetic organo-hydride produced from pyridine. J Am Chem Soc. 2014 Nov 12; 136(45):16081-95. PMID: 25323134.
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    57. Aguirre-Soto A, Lim CH, Hwang AT, Musgrave CB, Stansbury JW. Visible-light organic photocatalysis for latent radical-initiated polymerization via 2e?/1H? transfers: initiation with parallels to photosynthesis. J Am Chem Soc. 2014 May 21; 136(20):7418-27. PMID: 24786755.
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    58. Ford DD, Nielsen LP, Zuend SJ, Musgrave CB, Jacobsen EN. Mechanistic basis for high stereoselectivity and broad substrate scope in the (salen)Co(III)-catalyzed hydrolytic kinetic resolution. J Am Chem Soc. 2013 Oct 16; 135(41):15595-608. PMID: 24041239.
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    59. Lim CH, Holder AM, Hynes JT, Musgrave CB. Roles of the Lewis acid and base in the chemical reduction of CO2 catalyzed by frustrated Lewis pairs. Inorg Chem. 2013 Sep 03; 52(17):10062-6. PMID: 23941178.
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    60. Holder AM, Osborn KD, Lobb CJ, Musgrave CB. Bulk and surface tunneling hydrogen defects in alumina. Phys Rev Lett. 2013 Aug 09; 111(6):065901. PMID: 23971589.
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    61. Muhich CL, Evanko BW, Weston KC, Lichty P, Liang X, Martinek J, Musgrave CB, Weimer AW. Efficient generation of H2 by splitting water with an isothermal redox cycle. Science. 2013 Aug 02; 341(6145):540-2. PMID: 23908235.
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    62. Zimmerman PM, Musgrave CB, Head-Gordon M. A correlated electron view of singlet fission. Acc Chem Res. 2013 Jun 18; 46(6):1339-47. PMID: 23427823.
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    63. Lim CH, Holder AM, Musgrave CB. Mechanism of homogeneous reduction of CO2 by pyridine: proton relay in aqueous solvent and aromatic stabilization. J Am Chem Soc. 2013 Jan 09; 135(1):142-54. PMID: 23214714.
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    64. Zimmerman PM, Zhang Z, Musgrave CB. Simultaneous two-hydrogen transfer as a mechanism for efficient CO(2) reduction. Inorg Chem. 2010 Oct 04; 49(19):8724-8. PMID: 20804148.
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    65. Zimmerman PM, Zhang Z, Musgrave CB. Singlet fission in pentacene through multi-exciton quantum states. Nat Chem. 2010 Aug; 2(8):648-52. PMID: 20651727.
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    66. Ardalan P, Sun Y, Pianetta P, Musgrave CB, Bent SF. Reaction mechanism, bonding, and thermal stability of 1-alkanethiols self-assembled on halogenated Ge surfaces. Langmuir. 2010 Jun 01; 26(11):8419-29. PMID: 20433151.
      View in: PubMed
    67. Zimmerman PM, Toulouse J, Zhang Z, Musgrave CB, Umrigar CJ. Excited states of methylene from quantum Monte Carlo. J Chem Phys. 2009 Sep 28; 131(12):124103. PMID: 19791848.
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    68. Zimmerman PM, Paul A, Musgrave CB. Catalytic dehydrogenation of ammonia borane at Ni monocarbene and dicarbene catalysts. Inorg Chem. 2009 Jun 15; 48(12):5418-33. PMID: 19456138.
      View in: PubMed
    69. Ardalan P, Musgrave CB, Bent SF. Formation of alkanethiolate self-assembled monolayers at halide-terminated Ge surfaces. Langmuir. 2009 Feb 17; 25(4):2013-25. PMID: 19152272.
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    70. Zimmerman PM, Paul A, Zhang Z, Musgrave CB. Oligomerization and autocatalysis of NH2BH2 with ammonia-borane. Inorg Chem. 2009 Feb 02; 48(3):1069-81. PMID: 19125668.
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    71. Zimmerman PM, Paul A, Zhang Z, Musgrave CB. The role of free N-heterocyclic carbene (NHC) in the catalytic dehydrogenation of ammonia-borane in the nickel NHC system. Angew Chem Int Ed Engl. 2009; 48(12):2201-5. PMID: 19204967.
      View in: PubMed
    72. Mukhopadhyay AB, Musgrave CB, Fdez Sanz J. Atomic layer deposition of hafnium oxide from hafnium chloride and water. J Am Chem Soc. 2008 Sep 10; 130(36):11996-2006. PMID: 18698777.
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    73. Ha J, Hyun Yoon T, Wang Y, Musgrave CB, Brown GE. Adsorption of organic matter at mineral/water interfaces: 7. ATR-FTIR and quantum chemical study of lactate interactions with hematite nanoparticles. Langmuir. 2008 Jun 01; 24(13):6683-92. PMID: 18522441.
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    74. Zhang G, Musgrave CB. Comparison of DFT methods for molecular orbital eigenvalue calculations. J Phys Chem A. 2007 Mar 01; 111(8):1554-61. PMID: 17279730.
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    75. Paul A, Musgrave CB. Catalyzed dehydrogenation of ammonia-borane by iridium dihydrogen pincer complex differs from ethane dehydrogenation. Angew Chem Int Ed Engl. 2007; 46(43):8153-6. PMID: 17886331.
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    76. Solares SD, Dasgupta S, Schultz PA, Kim YH, Musgrave CB, Goddard WA. Density functional theory study of the geometry, energetics, and reconstruction process of Si111 surfaces. Langmuir. 2005 Dec 20; 21(26):12404-14. PMID: 16343021.
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    77. Mui C, Musgrave CB. Initial nitridation of the Ge(100)-2 x 1 surface by ammonia. Langmuir. 2005 May 24; 21(11):5230-2. PMID: 15896076.
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    78. Huang KW, Han JH, Cole AP, Musgrave CB, Waymouth RM. Homolysis of weak Ti-O bonds: experimental and theoretical studies of titanium oxygen bonds derived from stable nitroxyl radicals. J Am Chem Soc. 2005 Mar 23; 127(11):3807-16. PMID: 15771515.
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    79. Mui C, Senosiain JP, Musgrave CB. Initial oxidation and hydroxylation of the Ge(100)-2 x 1 surface by water and hydrogen peroxide. Langmuir. 2004 Aug 31; 20(18):7604-9. PMID: 15323508.
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    80. Mui C, Bent SF, Musgrave CB. A Density Functional Theory Study on the Effect of Ge Alloying on Hydrogen Desorption from SiGe Alloy Surfaces. J Phys Chem B. 2004 May 20; 108(20):6336-50. PMID: 18950120.
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    81. Widjaja Y, Musgrave CB. Indirect adsorbate-adsorbate interactions mediated through the surface electronic structure of the Si(100) surface. J Chem Phys. 2004 Jan 15; 120(3):1555-9. PMID: 15268282.
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    82. Filler MA, Mui C, Musgrave CB, Bent SF. Competition and selectivity in the reaction of nitriles on ge(100)-2x1. J Am Chem Soc. 2003 Apr 23; 125(16):4928-36. PMID: 12696912.
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    83. Wang GT, Mui C, Musgrave CB, Bent SF. Competition and selectivity of organic reactions on semiconductor surfaces: reaction of unsaturated ketones on Si(100)-2 x 1 and Ge(100)-2 x 1. J Am Chem Soc. 2002 Jul 31; 124(30):8990-9004. PMID: 12137555.
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    84. Mui C, Han JH, Wang GT, Musgrave CB, Bent SF. Proton transfer reactions on semiconductor surfaces. J Am Chem Soc. 2002 Apr 17; 124(15):4027-38. PMID: 11942841.
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    85. Senosiain JP, Han JH, Musgrave CB, Golden DM. Use of quantum methods for a consistent approach to combustion modelling: hydrocarbon bond dissociation energies. Faraday Discuss. 2001; (119):173-89; discussion 255-74. PMID: 11877990.
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