المؤلفون: Palmer, Michael H., Kivimäki, Antti, Hoffmann, Søren V., Jones, Nykola C., Coreno, Marcello, de Simone, Monica, Grazioli, Cesare, Aitken, R Alan, Patterson, Iain L. J., Perrault, Loëlia

المساهمون: University of St Andrews.School of Chemistry, University of St Andrews.EaSTCHEM

مصطلحات موضوعية: Configuration interaction, Coupled-cluster methods, Density functional theory, Excitation energies, Rydberg states, Vacuum ultraviolet radiation, Synchrotrons, Absorption spectroscopy, Photoelectron spectroscopy, Photoionization, NDAS

وصف الملف: application/pdf

Relation: Journal of Chemical Physics; 312347942; https://hdl.handle.net/10023/31175

الاتاحة: https://hdl.handle.net/10023/31175
https://doi.org/10.1063/5.0243859

المؤلفون: Palmer, Michael H., Vrønning Hoffmann, Søren, Jones, Nykola C., Coreno, Marcello, de Simone, Monica, Grazioli, Cesare, Aitken, R Alan, Perrault, Loelia, Patterson, Iain L. J.

المصدر: Palmer , M H , Vrønning Hoffmann , S , Jones , N C , Coreno , M , de Simone , M , Grazioli , C , Aitken , R A , Perrault , L & Patterson , I L J 2024 , ' The ultraviolet and vacuum ultraviolet absorption spectrum of gamma-pyrone; the singlet states studied by configuration interaction and density functional calculations ' , Journal of Chemical Physics , vol. 160 , no. 5 , 054305 . https://doi.org/10.1063/5.0186919

وصف الملف: application/pdf

الاتاحة: https://research-portal.st-andrews.ac.uk/en/publications/f1aa056b-783f-407d-a088-823c9decacbe
https://doi.org/10.1063/5.0186919
https://research-repository.st-andrews.ac.uk/bitstream/10023/29173/1/Palmer_2024_JCP_Ultraviolet_AAM.pdf

المؤلفون: Smellie, Iain A. (ORCID 0000-0002-5829-6487), Carpenter-Warren, Cameron L., Chalmers, Brian A. (ORCID 0000-0002-2999-2272), Cordes, David B. (ORCID 0000-0002-5366-9168), F. De A. Gouy, Rodrigo P., Keddie, Neil S. (ORCID 0000-0002-9502-5862), Lebl, Tomas (ORCID 0000-0002-0269-3221), Patterson, Iain. L. J., Slawin, Alexandra M. Z.

المصدر: Journal of Chemical Education. Nov 2021 98(11):3608-3613.

Peer Reviewed: Y

Page Count: 6

Descriptors: Science Instruction, Scientific Concepts, Concept Formation, Chemistry, Science Laboratories, College Science, Teaching Methods, Measurement Equipment, Hazardous Materials

المؤلفون: Smellie, Iain A. (ORCID 0000-0002-5829-6487), Abdelhamid, Yusra, Carpenter-Warren, Cameron L., Cordes, David B. (ORCID 0000-0002-5366-9168), Elliott, Clement, Lamorte, Sarah, Patterson, Iain L. J., Sanders, William, Sandison, Iain P., Slawin, Alexandra M. Z., Stewart, Dominic M., Walters, Samuel N.

المصدر: Journal of Chemical Education. Apr 2020 97(4):1203-1207.

Peer Reviewed: Y

Page Count: 5

Descriptors: Science Instruction, Science Experiments, Metallurgy, College Science, Undergraduate Study, Secondary School Science, High Schools, Scientific Concepts, Science Laboratories, Laboratory Experiments

المؤلفون: Keiller, Lauren, Patterson, Iain L. J., Stewart, Dominic, Smellie, Iain

المساهمون: University of St Andrews. Centre for Higher Education Research, University of St Andrews. EaSTCHEM, University of St Andrews. School of Chemistry

مصطلحات موضوعية: High school/introductory chemistry, First-year undergraduate/general, Demonstrations, Acid/bases, Aqueous solution chemistry, Plant, QD Chemistry, NDAS, MCC, QD

وصف الملف: application/pdf

Relation: Journal of Chemical Education; Keiller , L , Patterson , I L J , Stewart , D & Smellie , I 2023 , ' A simple and inexpensive invisible ink system based on red cabbage extracts ' , Journal of Chemical Education , vol. 100 , no. 3 , pp. 1398-1403 . https://doi.org/10.1021/acs.jchemed.2c01032; PURE: 283441989; PURE UUID: bed143d5-6bf8-48ed-a461-81265c19bbdb; ORCID: /0000-0002-5829-6487/work/130204500; Scopus: 85149140212; http://hdl.handle.net/10023/27080; https://doi.org/10.1021/acs.jchemed.2c01032

الاتاحة: http://hdl.handle.net/10023/27080
https://doi.org/10.1021/acs.jchemed.2c01032

المؤلفون: Palmer, Michael H, Jones, Nykola C, Hoffmann, Soren V, Aitken, R Alan, Coreno, Marcello, de Simone, Monica, Grazioli, Cesare, Patterson, Iain L J

المصدر: Palmer , M H , Jones , N C , Hoffmann , S V , Aitken , R A , Coreno , M , de Simone , M , Grazioli , C & Patterson , I L J 2022 , ' The excited states of azulene; a study of the vibrational energy levels for the lower ππ*-valence states by configuration interaction and density functional calculations, and theoretical studies of the Rydberg states ' , The Journal of Chemical Physics , vol. 157 , no. 15 , 154307 . https://doi.org/10.1063/5.0106697

الاتاحة: https://risweb.st-andrews.ac.uk/portal/en/researchoutput/the-excited-states-of-azulene-a-study-of-the-vibrational-energy-levels-for-the-lower-valence-states-by-configuration-interaction-and-density-functional-calculations-and-theoretical-studies-of-the-rydberg-states(3fd9bc46-831c-491c-acba-ebd259c8ddbb).html
https://doi.org/10.1063/5.0106697

المؤلفون: Palmer, Michael H., Jones, Nykola C., Hoffmann, Søren Vrønning, Aitken, R. Alan, Coreno, Marcello, de Simone, Monica, Grazioli, Cesare, Patterson, Iain L. J.

المصدر: Journal of Chemical Physics; 10/21/2022, Vol. 157 Issue 15, p1-15, 15p

مصطلحات موضوعية: RYDBERG states, EXCITED state energies, EXCITED states, SYNCHROTRON radiation sources, DENSITY functionals, ENERGY levels (Quantum mechanics), SYNCHROTRON radiation, PHOTOELECTRONS

المؤلفون: Palmer, Michael H., Hoffmann, Søren Vrønning, Jones, Nykola C., Coreno, Marcello, De Simone, Monica, Grazioli, Cesare, Aitken, R. Alan, Perrault, Loëlia, Patterson, Iain L. J.

المصدر: Palmer , M H , Hoffmann , S V , Jones , N C , Coreno , M , De Simone , M , Grazioli , C , Aitken , R A , Perrault , L & Patterson , I L J 2024 , ' The synchrotron based ultraviolet and vacuum ultraviolet absorption spectrum of gamma-pyrone; the singlet states studied by configuration interaction and density functional calculations. ' , The Journal of Chemical Physics .

مصطلحات موضوعية: envir, geo

Relation: https://pure.au.dk/portal/en/publications/0ce477ef-96a2-4711-9d8a-36989b52d952

الاتاحة: https://pure.au.dk/portal/en/publications/0ce477ef-96a2-4711-9d8a-36989b52d952

المؤلفون: Smellie, Iain, Patterson, Iain L. J.

المصدر: Smellie , I & Patterson , I L J 2024 , ' Changing the Colour of Whole Fruits! ' Chemical Education Xchange (ChemEdX) . < https://www.chemedx.org/article/changing-colour-whole-fruits >

الاتاحة: https://research-portal.st-andrews.ac.uk/en/publications/0db24ec8-3893-418f-a801-115ffc63ba7d
https://www.chemedx.org/article/changing-colour-whole-fruits

المؤلفون: Smellie, Iain, Patterson, Iain L. J.

المصدر: Smellie , I & Patterson , I L J 2024 , ' What are the molecular structures of sulfonphthalein acid-base indicators? ' Chemical Education Xchange (ChemEdX) . < https://www.chemedx.org/article/what-are-molecular-structures-sulfonphthalein-acid-base-indicators >

الاتاحة: https://research-portal.st-andrews.ac.uk/en/publications/7d06ca00-b8a3-4ffd-89de-df49938bb195
https://www.chemedx.org/article/what-are-molecular-structures-sulfonphthalein-acid-base-indicators

المؤلفون: Smellie, Iain, Schaub, Renald, Patterson, Iain L. J., Armitage, Alexandra

المصدر: Smellie , I , Schaub , R , Patterson , I L J & Armitage , A 2024 , ' Colour Changes with Caffeine - Part 2 ' Chemical Education Xchange (ChemEdX) . < http://www.chemedx.org/article/colour-changes-caffeine-part-2 >

الاتاحة: https://research-portal.st-andrews.ac.uk/en/publications/e2317aa9-2e9d-4c95-ad51-f6b61bebf4f9
http://www.chemedx.org/article/colour-changes-caffeine-part-2

المؤلفون: Smellie, Iain, Patterson, Iain L. J., Schaub, Renald, Armitage, Alexandra

المصدر: Smellie , I , Patterson , I L J , Schaub , R & Armitage , A 2023 , ' Colour Changes with Caffeine ' Chemical Education Xchange (ChemEdX) . < https://www.chemedx.org/article/colour-changes-caffeine >

الاتاحة: https://research-portal.st-andrews.ac.uk/en/publications/0c46d6e1-dce6-48f4-9369-074f7b981fa6
https://www.chemedx.org/article/colour-changes-caffeine

المؤلفون: Smellie, Iain, Patterson, Iain L. J.

المصدر: Smellie , I & Patterson , I L J 2023 , ' Colourful Chemistry of Canning Part 4 ' Chemical Education Xchange (ChemEdX) . < https://www.chemedx.org/article/colourful-chemistry-canning-%E2%80%93-part-4 >

الاتاحة: https://research-portal.st-andrews.ac.uk/en/publications/03bc2704-1639-49c7-9b9f-cf72b839bcb1
https://www.chemedx.org/article/colourful-chemistry-canning-%E2%80%93-part-4

المؤلفون: Smellie, Iain, Patterson, Iain L. J.

المصدر: Smellie , I & Patterson , I L J 2023 , ' Colourful Chemistry of Canning Part 5 ' Chemical Education Xchange (ChemEdX) . < https://www.chemedx.org/article/colourful-chemistry-canning-%E2%80%93-part-5 >

الاتاحة: https://research-portal.st-andrews.ac.uk/en/publications/02d25a15-1fa2-455e-b182-a0abd7b76e60
https://www.chemedx.org/article/colourful-chemistry-canning-%E2%80%93-part-5

المؤلفون: Smellie, Iain, Patterson, Iain L. J., Chalmers, Brian Alexander

المصدر: Smellie , I , Patterson , I L J & Chalmers , B A 2023 , ' Colourful chemistry of canning: part 3 ' Chemical Education Xchange (ChemEdX) . < http://www.chemedx.org/article/colourful-chemistry-canning-%E2%80%93-part-3 >

الاتاحة: https://research-portal.st-andrews.ac.uk/en/publications/ef32d669-0a84-4b98-a4ce-7f3c8a5ee05d
http://www.chemedx.org/article/colourful-chemistry-canning-%E2%80%93-part-3

المؤلفون: Jones, Kevin M., Smellie, Iain A., Patterson, Iain L. J.

المصدر: Jones , K M , Smellie , I A & Patterson , I L J 2017 , ' An easily-assembled Soxhlet extractor to demonstrate continuous extraction ' , Journal of Chemical Education , vol. 94 , no. 6 , pp. 819-820 . https://doi.org/10.1021/acs.jchemed.6b00965

مصطلحات موضوعية: High school/introductory chemistry, First-year undergraduate/general, Analytical Chemistry, Hands-on learning/manipulatives

وصف الملف: application/pdf

الاتاحة: https://risweb.st-andrews.ac.uk/portal/en/researchoutput/an-easilyassembled-soxhlet-extractor-to-demonstrate-continuous-extraction(7dc17202-8ec1-476f-85c5-49bfd8b782d7).html
https://doi.org/10.1021/acs.jchemed.6b00965
https://research-repository.st-andrews.ac.uk/bitstream/10023/14032/1/Jones_2017_JoCE_SoxhletExtractor_AAM.pdf
http://pubs.acs.org/doi/suppl/10.1021/acs.jchemed.6b00965

المؤلفون: Smellie, Iain A., Aldred (née Prentis), Joanna K. D., Bower, Benjamin, Cochrane, Amber, Macfarlane, Laurie, McCarron, Hollie B., O'Hara, Roxanna, Patterson, Iain L. J., Thomson, Marie I., Walker, Jessica M.

المصدر: Smellie , I A , Aldred (née Prentis) , J K D , Bower , B , Cochrane , A , Macfarlane , L , McCarron , H B , O'Hara , R , Patterson , I L J , Thomson , M I & Walker , J M 2017 , ' Alternative hydrogen peroxide sources for peroxyoxalate “glowstick” chemiluminescence demonstrations ' , Journal of Chemical Education , vol. 94 , no. 1 , pp. 112-114 . https://doi.org/10.1021/acs.jchemed.6b00536

مصطلحات موضوعية: General public, High School/Introductory Chemistry, Demonstrations, Organic chemistry, Public understanding/outreach, Analogies/transfer, Esters, Oxidation/reduction, Phenols

وصف الملف: application/pdf

الاتاحة: https://risweb.st-andrews.ac.uk/portal/en/researchoutput/alternative-hydrogen-peroxide-sources-for-peroxyoxalate-glowstick-chemiluminescence-demonstrations(5001ff03-c0d9-42dd-9c75-8721d1354296).html
https://doi.org/10.1021/acs.jchemed.6b00536
https://research-repository.st-andrews.ac.uk/bitstream/10023/12134/1/Glowstick_paper_28_10_2016_.pdf
http://pubs.acs.org/doi/suppl/10.1021/acs.jchemed.6b00536

المؤلفون: Smellie, Iain, Abdelhamid, Yusra, Carpenter-Warren, Cameron Lewis, Cordes, David Bradford, Elliott, Clement, Lamorte, Sarah, Patterson, Iain L. J., Sanders, William, Sandison, Iain P., Slawin, Alexandra Martha Zoya, Stewart, Dominic M., Walters, Samuel N.

المصدر: Smellie , I , Abdelhamid , Y , Carpenter-Warren , C L , Cordes , D B , Elliott , C , Lamorte , S , Patterson , I L J , Sanders , W , Sandison , I P , Slawin , A M Z , Stewart , D M & Walters , S N 2020 , ' A simplified extractive metallurgy exercise to demonstrate selective extraction of copper ' , Journal of Chemical Education , vol. 97 , no. 4 , pp. 1203-1207 . https://doi.org/10.1021/acs.jchemed.9b00996

مصطلحات موضوعية: High School/Introductory Chemistry, First-Year Undergraduate/General, Interdisciplinary/Multidisciplinary, Laboratory Instruction, Hands-On Learning/Manipulatives, Problem Solving/Decision Making, Applications of Chemistry, Coordination Compounds, Metallurgy, Qualitative Analysis, UV−Vis Spectroscopy, psy, envir

Relation: https://research-repository.st-andrews.ac.uk/bitstream/10023/21439/1/IAS_Copper_2_FINAL_.pdf; https://risweb.st-andrews.ac.uk/portal/en/researchoutput/a-simplified-extractive-metallurgy-exercise-to-demonstrate-selective-extraction-of-copper(9c98c0c8-e5ca-48a7-b03d-000862094770).html

الاتاحة: https://research-repository.st-andrews.ac.uk/bitstream/10023/21439/1/IAS_Copper_2_FINAL_.pdf
https://risweb.st-andrews.ac.uk/portal/en/researchoutput/a-simplified-extractive-metallurgy-exercise-to-demonstrate-selective-extraction-of-copper(9c98c0c8-e5ca-48a7-b03d-000862094770).html

المؤلفون: Smellie, Iain Archie, Botting, Nigel Peter, Chalmers, Brian Alexander, Harper, Andrew David, Patterson, Iain L. J.

المساهمون: Afonso, Carlos A. M., Candeias, Nuno R., Simão, Dulce Pereira, Trinidade, Alexandre F., Coelho, Jaime A. S., Tan, Bin, Franzén, Robert

المصدر: Smellie , I A , Botting , N P , Chalmers , B A , Harper , A D & Patterson , I L J 2016 , Heterocyclic Target Synthesis - Three-step Syntheses from Benzaldehyde . in C A M Afonso , N R Candeias , D P Simão , A F Trinidade , J A S Coelho , B Tan & R Franzén (eds) , Comprehensive Organic Chemistry Experiments for the Laboratory Classroom . Royal Society of Chemistry , pp. 720-724 .

الاتاحة: https://risweb.st-andrews.ac.uk/portal/en/researchoutput/heterocyclic-target-synthesis--threestep-syntheses-from-benzaldehyde(c1fd8a09-831e-4249-a2c7-5da6c78763f9).html

المؤلفون: Smellie, Iain Archie, Chalmers, Brian Alexander, Botting, Nigel Peter, Patterson, Iain L. J.

المساهمون: Afonso, Carlos A. M., Candeias, Nuno R., Simão, Dulce Pereira, Trinidade, Alexandre F., Coelho, Jaime A. S., Tan, Bin, Franzén, Robert

المصدر: Smellie , I A , Chalmers , B A , Botting , N P & Patterson , I L J 2016 , Halogenation Reactions of Vanillin . in C A M Afonso , N R Candeias , D P Simão , A F Trinidade , J A S Coelho , B Tan & R Franzén (eds) , Comprehensive Organic Chemistry Experiments for the Laboratory Classroom . Royal Society of Chemistry , pp. 451-453 .

الاتاحة: https://risweb.st-andrews.ac.uk/portal/en/researchoutput/halogenation-reactions-of-vanillin(6f587e9b-5f70-4e7a-a591-697470e332e8).html