Evans Adei, Ph.D - Publications

Affiliations: 
Chemistry University of California, Irvine, Irvine, CA 
Area:
Computational Quantum / Theoretical Chemistry
Website:
http://www.knust.edu.gh/pages/sections.php?siteid=chemistry&mid=806&sid=2758&id=573

38 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2021 Ofori I, Pipim GB, Tia R, Adei E. A DFT study of the double (3 + 2) cycloaddition of nitrile oxides and allenoates for the formation of spirobiisoxazolines. Journal of Molecular Graphics & Modelling. 109: 108033. PMID 34534890 DOI: 10.1016/j.jmgm.2021.108033  1
2021 Tawiah A, Pipim GB, Tia R, Adei E. Exploring the chemo-, regio-, and stereoselectivities of the (3 + 2) cycloaddition reaction of 5,5-dimethyl-3-methylene-2-pyrrolidinone with C,N-diarylnitrones and nitrile oxide derivatives: a DFT study. Journal of Molecular Modeling. 27: 287. PMID 34532750 DOI: 10.1007/s00894-021-04911-0  1
2021 Atta-Kumi J, Pipim GB, Tia R, Adei E. Investigating the site-, regio-, and stereo-selectivities of the reactions between organic azide and 7-heteronorbornadiene: a DFT mechanistic study. Journal of Molecular Modeling. 27: 248. PMID 34387742 DOI: 10.1007/s00894-021-04857-3  1
2021 Abdulai AY, Tia R, Adei E. A DFT mechanistic study on oxidative dehydrogenative Diels-Alder reaction of alkylbenzenes. Journal of Molecular Graphics & Modelling. 104: 107839. PMID 33524922 DOI: 10.1016/j.jmgm.2021.107839  1
2020 Pipim GB, Tia R, Adei E. (3 + 2) cycloaddition reaction of 7-isopropylidenebenzonorbornadiene and diazomethane derivatives: A theoretical study. Journal of Molecular Graphics & Modelling. 101: 107713. PMID 32882633 DOI: 10.1016/J.Jmgm.2020.107713  1
2020 Pipim GB, Tia R, Adei E. Investigating the regio-, stereo-, and enantio-selectivities of the 1,3-dipolar cycloaddition reaction of C-cyclopropyl-N-phenylnitrone derivatives and benzylidenecyclopropane derivatives: A DFT study. Journal of Molecular Graphics & Modelling. 100: 107672. PMID 32659628 DOI: 10.1016/J.Jmgm.2020.107672  1
2020 Aniagyei A, Kwawu C, Tia R, Adei E. Permanganyl chloride-mediated oxidation of tetramethylethylene: A density functional theory study. Journal of Molecular Graphics & Modelling. 98: 107616. PMID 32302937 DOI: 10.1016/J.Jmgm.2020.107616  1
2020 Pipim GB, Opoku E, Tia R, Adei E. Peri-, Chemo-, Regio-, Stereo- and Enantio-Selectivities of 1,3-dipolar cycloaddition reaction of C,N-Disubstituted nitrones with disubstituted 4-methylene-1,3-oxazol-5(4H)- one: A quantum mechanical study. Journal of Molecular Graphics & Modelling. 97: 107542. PMID 32004806 DOI: 10.1016/J.Jmgm.2020.107542  1
2020 Umar AR, Tia R, Adei E. DFT mechanistic studies on the regio-, stereo-, and enantio-selectivity of 1,3 dipolar cycloadditions of quinolinium imides with olefins, maleimides, and benzynes for the synthesis of fused N,N'-heterocycles. Journal of Molecular Modeling. 26: 36. PMID 31989273 DOI: 10.1007/S00894-020-4299-6  1
2020 Amoah A, Tia R, Adei E. A DFT mechanistic study on [4 + 3] cycloaddition reactions of oxyallyl cations and five-membered cyclopentadiene derivatives Tetrahedron. 76: 131422. DOI: 10.1016/J.Tet.2020.131422  1
2020 Samba WK, Tia R, Adei E. Regio‐, enantio‐, peri‐, and stereo‐selectivities of the reactions of five‐membered cyclodiene derivatives with itaconic anhydride toward the formation of norbornene lactones Journal of Physical Organic Chemistry. DOI: 10.1002/Poc.4132  1
2019 Borketey JB, Opoku E, Tia R, Adei E. The mechanisms of gallium-catalysed skeletal rearrangement of 1,6-enynes - Insights from quantum mechanical computations. Journal of Molecular Graphics & Modelling. 94: 107476. PMID 31627116 DOI: 10.1016/J.Jmgm.2019.107476  1
2019 Roland D, Haleegoah JN, Opoku E, Tia R, Adei E. Mechanistic studies on tandem cascade [4 + 2]/ [3 + 2] cycloaddition of 1,3,4-oxadiazoles with olefins. Journal of Molecular Graphics & Modelling. 93: 107452. PMID 31541992 DOI: 10.1016/J.Jmgm.2019.107452  1
2019 Arhin G, Adams AH, Opoku E, Tia R, Adei E. 1, 3-Dipolar cycloaddition reactions of selected 1,3-dipoles with 7-isopropylidenenorbornadiene and follow-up thermolytic cleavage: A computational study. Journal of Molecular Graphics & Modelling. 92: 267-279. PMID 31425904 DOI: 10.1016/J.Jmgm.2019.08.004  1
2019 Opoku E, Tia R, Adei E. Quantum chemical studies on the mechanistic aspects of tandem sequential cycloaddition reactions of cyclooctatetraene with ester and nitrones. Journal of Molecular Graphics & Modelling. 92: 17-31. PMID 31302500 DOI: 10.1016/J.Jmgm.2019.06.019  1
2019 Opoku E, Tia R, Adei E. Computational studies on [4 + 2] / [3 + 2] tandem sequential cycloaddition reactions of functionalized acetylenes with cyclopentadiene and diazoalkane for the formation of norbornene pyrazolines. Journal of Molecular Modeling. 25: 168. PMID 31119394 DOI: 10.1007/S00894-019-4056-X  1
2018 Aniagyei A, Dzade NY, Tia R, Adei E, Catlow CRA, de Leeuw NH. Ab initio investigation of O adsorption on Ca-doped LaMnO cathodes in solid oxide fuel cells. Physical Chemistry Chemical Physics : Pccp. 20: 28685-28698. PMID 30411098 DOI: 10.1039/C8Cp02137F  1
2018 Boafo EA, Darko K, Afriyie BA, Tia R, Adei E. Trapping of 1,2-cyclohexadiene: A DFT mechanistic study on the reaction of 1,2-cyclohexadiene with olefins and nitrones. Journal of Molecular Graphics & Modelling. 81: 1-13. PMID 29455042 DOI: 10.1016/J.Jmgm.2018.02.003  1
2017 Bekoe S, Osei MK, Tia R, Adei E. Density functional theory studies on the generation of trimethylenemethanes from the ring opening of dialkoxymethylenecyclopropanes and methylenecyclopropanethioacetals and follow-up reactions. Journal of Molecular Modeling. 24: 24. PMID 29270701 DOI: 10.1007/S00894-017-3558-7  1
2017 Kwawu CR, Tia R, Adei E, Dzade NY, Catlow CRA, de Leeuw NH. CO2 activation and dissociation on the low miller index surfaces of pure and Ni-coated iron metal: a DFT study. Physical Chemistry Chemical Physics : Pccp. PMID 28718470 DOI: 10.1039/C7Cp03466K  1
2017 Boateng IW, Tia R, Adei E, Dzade NY, Catlow CR, de Leeuw NH. A DFT+U investigation of hydrogen adsorption on the LaFeO3(010) surface. Physical Chemistry Chemical Physics : Pccp. PMID 28243636 DOI: 10.1039/C6Cp08698E  1
2016 Mensah M, Amepetey EE, Tia R, Adei E. 1,3-Dipolar [3 + 2] cycloaddition reactions of N,C,C-trisubstituted nitrones with ring-acceptor methylenecyclopropanes: a computational study. Springerplus. 5: 2072. PMID 28018780 DOI: 10.1186/S40064-016-3758-0  1
2016 Ahmed I, Tia R, Adei E. A quantum chemical study of the mechanisms of olefin addition to group 9 transition metal dioxo compounds. Springerplus. 5: 867. PMID 27386316 DOI: 10.1186/S40064-016-2582-X  1
2016 Aniagyei A, Tia R, Adei E. A computational study of the addition of ReO3L (L = Cl(-), CH3, OCH3 and Cp) to ethenone. Springerplus. 5: 354. PMID 27066367 DOI: 10.1186/S40064-016-2012-0  1
2016 Awuah JB, Dzade NY, Tia R, Adei E, Kwakye-Awuah B, Richard A Catlow C, de Leeuw NH. A density functional theory study of arsenic immobilization by the Al(iii)-modified zeolite clinoptilolite. Physical Chemistry Chemical Physics : Pccp. PMID 27052997 DOI: 10.1039/C6Cp00190D  1
2016 Ahmed I, Tia R, Adei E. Exploring the peri-, chemo-, and regio-selectivity of addition of manganese metal oxides MnO3L (L = Cl-, O-, OCH3, CH3) to substituted ketenes: A computational study Inorganica Chimica Acta. 441: 57-66. DOI: 10.1016/J.Ica.2015.11.006  1
2015 Ahmed I, Tia R, Adei E. A density functional theory study of the mechanisms of addition of transition metal oxides ReO3L(L =Cl-,O-,OCH3, CH3) to substituted ketenes Journal of Theoretical and Computational Chemistry. 14. DOI: 10.1142/S0219633615500352  1
2014 Akoto O, Bismark Eshun F, Darko G, Adei E. Concentrations and health risk assessments of heavy metals in fish from the Fosu Lagoon International Journal of Environmental Research. 8: 403-410.  1
2013 Aniagyei A, Tia R, Adei E. A theoretical study of the mechanisms of oxidation of ethylene by manganese oxo complexes. Dalton Transactions (Cambridge, England : 2003). 42: 14411-23. PMID 23963205 DOI: 10.1039/C3Dt51700D  1
2013 Aniagyei A, Tia R, Adei E. A density functional theory study of the mechanisms of oxidation of ethylene by rhenium oxide complexes. Dalton Transactions (Cambridge, England : 2003). 42: 10885-97. PMID 23807370 DOI: 10.1039/C3Dt50539A  1
2013 Aniagyei A, Tia R, Adei E. A density functional theory study of the mechanisms of oxidation of ethylene by technetium oxo complexes Computational and Theoretical Chemistry. 1009: 70-80. DOI: 10.1016/J.Comptc.2013.01.006  1
2012 Mensah JK, Adei E, Adei D, Owusu Ansah G. Assessment of local wood species used for the manufacture of cookware and the perception of chemical benefits and chemical hazards associated with their use in Kumasi, Ghana. Journal of Ethnobiology and Ethnomedicine. 8: 46. PMID 23244596 DOI: 10.1186/1746-4269-8-46  1
2012 Enweronu-Laryea CC, Aryee IN, Adei EA. Severe acute malnutrition in very low birth weight preterm infants. Jpen. Journal of Parenteral and Enteral Nutrition. 36: 354-7. PMID 22179523 DOI: 10.1177/0148607111421789  1
2011 Tia R, Adei E. [3+2] Versus [2+2] addition of metal oxides across CC bonds: A theoretical study of the mechanisms of oxidation of ethylene by osmium oxide complexes Computational and Theoretical Chemistry. 977: 140-147. DOI: 10.1016/J.Comptc.2011.09.027  1
2011 Tia R, Adei E. Computational studies of the mechanistic aspects of olefin metathesis reactions involving metal oxo-alkylidene complexes Computational and Theoretical Chemistry. 971: 8-18. DOI: 10.1016/J.Comptc.2011.05.032  1
2010 Tia R, Adei E. Density functional theory studies of the mechanistic aspects of olefin metathesis reactions. Dalton Transactions (Cambridge, England : 2003). 39: 7575-87. PMID 20623044 DOI: 10.1039/C002245D  1
2009 Tia R, Adei E. Density functional theory study of the mechanisms of oxidation of ethylene by chromyl chloride. Inorganic Chemistry. 48: 11434-43. PMID 19891436 DOI: 10.1021/Ic901648Y  1
2008 Adei E, Forson-Adaboh K. Toxic (Pb, Cd, Hg) and essential (Fe, Cu, Zn, Mn) metal content of liver tissue of some domestic and bush animals in Ghana. Food Additives & Contaminants. Part B, Surveillance. 1: 100-5. PMID 24784805 DOI: 10.1080/02652030802566319  1
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