Year |
Citation |
Score |
2022 |
Runeson JE, Mannouch JR, Amati G, Fiechter MR, Richardson JO. Spin-Mapping Methods for Simulating Ultrafast Nonadiabatic Dynamics. Chimia. 76: 582-588. PMID 38069729 DOI: 10.2533/chimia.2022.582 |
0.321 |
|
2022 |
Ansari IM, Heller ER, Trenins G, Richardson JO. Instanton theory for Fermi's golden rule and beyond. Philosophical Transactions. Series a, Mathematical, Physical, and Engineering Sciences. 380: 20200378. PMID 35341312 DOI: 10.1098/rsta.2020.0378 |
0.321 |
|
2020 |
Gao X, Sallerr MAC, Liu Y, Kelly A, Richardson JO, Geva E. Benchmarking Quasiclassical Mapping Hamiltonian Methods for Simulating Electronically Nonadiabatic Molecular Dynamics. Journal of Chemical Theory and Computation. PMID 32227993 DOI: 10.1021/Acs.Jctc.9B01267 |
0.537 |
|
2019 |
Fang W, Thapa MJ, Richardson JO. Nonadiabatic quantum transition-state theory in the golden-rule limit. II. Overcoming the pitfalls of the saddle-point and semiclassical approximations. The Journal of Chemical Physics. 151: 214101. PMID 31822067 DOI: 10.1063/1.5131092 |
0.31 |
|
2019 |
Saller MAC, Kelly A, Richardson JO. Improved population operators for multi-state nonadiabatic dynamics with the mixed quantum-classical mapping approach. Faraday Discussions. PMID 31549127 DOI: 10.1039/C9Fd00050J |
0.654 |
|
2019 |
Winter P, Richardson JO. Divide-and-Conquer Method for Instanton Rate Theory. Journal of Chemical Theory and Computation. PMID 30896945 DOI: 10.1021/acs.jctc.8b01267 |
0.321 |
|
2019 |
Thapa MJ, Fang W, Richardson JO. Nonadiabatic quantum transition-state theory in the golden-rule limit. I. Theory and application to model systems. The Journal of Chemical Physics. 150: 104107. PMID 30876356 DOI: 10.1063/1.5081108 |
0.331 |
|
2019 |
Saller MAC, Kelly A, Richardson JO. On the identity of the identity operator in nonadiabatic linearized semiclassical dynamics. The Journal of Chemical Physics. 150: 071101. PMID 30795664 DOI: 10.1063/1.5082596 |
0.68 |
|
2018 |
Bacic Z, Benoit D, Biczysko M, Bowman J, Bradforth S, Burd T, Chambaud G, Clary D, Crépin C, Dracinsky M, Felker P, Fischer I, Gianturco F, Hochlaf M, Kouril K, ... ... Richardson J, et al. Molecules in confinement in clusters, quantum solvents and matrices: general discussion. Faraday Discussions. PMID 30520925 DOI: 10.1039/C8Fd90053A |
0.55 |
|
2018 |
Babikov D, Benoit D, Bowman J, Burd T, Clary D, Donovan R, Fischer I, Gianturco F, Hochlaf M, Kar S, Kirrander A, Leone S, Malcomson T, Manthe U, McCoy AB, ... ... Richardson J, et al. Quantum dynamics of isolated molecules: general discussion. Faraday Discussions. PMID 30511069 DOI: 10.1039/C8Fd90052C |
0.568 |
|
2018 |
Ban L, Bowman J, Bradforth S, Chambaud G, Dracinsky M, Fischer I, Góra R, Hochlaf M, Janicki M, Kirrander A, McCoy AB, Petersen J, Richardson J, Slavicek P, Szalewicz K, et al. Molecules in confinement in liquid solvents: general discussion. Faraday Discussions. PMID 30511066 DOI: 10.1039/C8Fd90051E |
0.347 |
|
2018 |
Bacic Z, Benoit D, Besemer M, Bowman J, Bradforth S, Clary D, Donovan R, Fischer I, Gianturco F, Hochlaf M, Houston P, Knowles P, Leone S, Linguerri R, Manthe U, ... ... Richardson J, et al. Precise characterisation of isolated molecules: general discussion. Faraday Discussions. PMID 30507986 DOI: 10.1039/C8Fd90050G |
0.529 |
|
2018 |
Richardson JO. Perspective: Ring-polymer instanton theory. The Journal of Chemical Physics. 148: 200901. PMID 29865828 DOI: 10.1063/1.5028352 |
0.302 |
|
2017 |
Karandashev K, Xu ZH, Meuwly M, Vaníček J, Richardson JO. Kinetic isotope effects and how to describe them. Structural Dynamics (Melville, N.Y.). 4: 061501. PMID 29282447 DOI: 10.1063/1.4996339 |
0.312 |
|
2017 |
Richardson JO, Meyer P, Pleinert M, Thoss M. An analysis of nonadiabatic ring-polymer molecular dynamics and its application to vibronic spectra Chemical Physics. 482: 124-134. DOI: 10.1016/J.Chemphys.2016.09.036 |
0.559 |
|
2016 |
Althorpe SC, Beniwal V, Bolhuis PG, Brandão J, Clary DC, Ellis J, Fang W, Glowacki DR, Hele TJ, Jónsson H, Kästner J, Makri N, Manolopoulos DE, McKemmish LK, Menzl G, ... ... Richardson JO, et al. Fundamentals: general discussion. Faraday Discussions. PMID 27942654 DOI: 10.1039/C6Fd90077A |
0.665 |
|
2016 |
Angulo G, Astumian RD, Beniwal V, Bolhuis PG, Dellago C, Ellis J, Ensing B, Glowacki DR, Hammes-Schiffer S, Kästner J, Lelièvre T, Makri N, Manolopoulos D, Menzl G, Miller TF, ... ... Richardson J, et al. New methods: general discussion. Faraday Discussions. PMID 27929586 DOI: 10.1039/C6Fd90075E |
0.381 |
|
2016 |
Althorpe SC, Ananth N, Angulo G, Astumian RD, Beniwal V, Blumberger J, Bolhuis PG, Ensing B, Glowacki DR, Habershon S, Hammes-Schiffer S, Hele TJ, Makri N, Manolopoulos DE, McKemmish LK, ... ... Richardson JO, et al. Non-adiabatic reactions: general discussion. Faraday Discussions. PMID 27929583 DOI: 10.1039/C6Fd90078J |
0.641 |
|
2016 |
Beyer AN, Richardson JO, Knowles PJ, Rommel J, Althorpe SC. Quantum Tunneling Rates of Gas-Phase Reactions from On-the-Fly Instanton Calculations. The Journal of Physical Chemistry Letters. 4374-4379. PMID 27775889 DOI: 10.1021/Acs.Jpclett.6B02115 |
0.616 |
|
2016 |
Richardson JO, Pérez C, Lobsiger S, Reid AA, Temelso B, Shields GC, Kisiel Z, Wales DJ, Pate BH, Althorpe SC. Concerted hydrogen-bond breaking by quantum tunneling in the water hexamer prism. Science (New York, N.Y.). 351: 1310-3. PMID 26989250 DOI: 10.1126/Science.Aae0012 |
0.544 |
|
2015 |
Richardson JO, Bauer R, Thoss M. Semiclassical Green's functions and an instanton formulation of electron-transfer rates in the nonadiabatic limit. The Journal of Chemical Physics. 143: 134115. PMID 26450300 DOI: 10.1063/1.4932361 |
0.566 |
|
2014 |
Pérez de Tudela R, Suleimanov YV, Richardson JO, Sáez Rábanos V, Green WH, Aoiz FJ. Stress Test for Quantum Dynamics Approximations: Deep Tunneling in the Muonium Exchange Reaction D + HMu → DMu + H. The Journal of Physical Chemistry Letters. 5: 4219-24. PMID 26278957 DOI: 10.1021/Jz502216G |
0.321 |
|
2014 |
Richardson JO, Thoss M. Non-oscillatory flux correlation functions for efficient nonadiabatic rate theory. The Journal of Chemical Physics. 141: 074106. PMID 25149774 DOI: 10.1063/1.4892865 |
0.579 |
|
2013 |
Richardson JO, Thoss M. Communication: nonadiabatic ring-polymer molecular dynamics. The Journal of Chemical Physics. 139: 031102. PMID 23883003 DOI: 10.1063/1.4816124 |
0.569 |
|
2013 |
Richardson JO, Wales DJ, Althorpe SC, McLaughlin RP, Viant MR, Shih O, Saykally RJ. Investigation of terahertz vibration-rotation tunneling spectra for the water octamer. The Journal of Physical Chemistry. A. 117: 6960-6. PMID 23286830 DOI: 10.1021/Jp311306A |
0.561 |
|
2011 |
Richardson JO, Althorpe SC, Wales DJ. Instanton calculations of tunneling splittings for water dimer and trimer. The Journal of Chemical Physics. 135: 124109. PMID 21974514 DOI: 10.1063/1.3640429 |
0.568 |
|
2011 |
Richardson JO, Althorpe SC. Ring-polymer instanton method for calculating tunneling splittings. The Journal of Chemical Physics. 134: 054109. PMID 21303094 DOI: 10.1063/1.3530589 |
0.588 |
|
2009 |
Richardson JO, Althorpe SC. Ring-polymer molecular dynamics rate-theory in the deep-tunneling regime: Connection with semiclassical instanton theory. The Journal of Chemical Physics. 131: 214106. PMID 19968336 DOI: 10.1063/1.3267318 |
0.609 |
|
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