| Publication | Date of Publication | Type |
|---|
| UKRmol+: a suite for modelling electronic processes in molecules interacting with electrons, positrons and photons using the R-matrix method | 2023-04-25 | Paper |
| The variational quantum eigensolver: a review of methods and best practices | 2022-11-02 | Paper |
| The NaOUCMe dataset for 23Na-16O | 2021-11-17 | Dataset |
| The SiOUVenIR dataset for 28Si-16O | 2021-11-05 | Dataset |
| Supplementary Data for Calculated Electron Impact Ionization Fragmentation Patterns | 2021-09-07 | Dataset |
| The Toto dataset for 48Ti16O | 2021-08-25 | Dataset |
| The ATP dataset for 27Al18O | 2021-06-22 | Dataset |
| The ATP dataset for 27Al17O | 2021-06-22 | Dataset |
| The ATP dataset for 27Al16O | 2021-06-22 | Dataset |
| The ATP dataset for 26Al16O | 2021-06-22 | Dataset |
| General mathematical formulation of scattering processes in atom–diatomic collisions in the RmatReact methodology | 2021-06-15 | Paper |
| The Trihybrid dataset for 13C15N | 2021-05-26 | Dataset |
| The Trihybrid dataset for 13C14N | 2021-05-26 | Dataset |
| The Trihybrid dataset for 12C15N | 2021-05-26 | Dataset |
| The Trihybrid dataset for 12C14N | 2021-05-26 | Dataset |
| The XABC dataset for 14N16O | 2021-04-22 | Dataset |
| The OYT5 dataset for 23Na16O1H | 2020-12-01 | Dataset |
| The OYT4 dataset for 39K16O1H | 2020-12-01 | Dataset |
| The 8states dataset for 13C2 | 2020-11-08 | Dataset |
| The 8states dataset for 12C13C | 2020-08-24 | Dataset |
| The CoYuTe dataset for 14N1H3 | 2020-07-30 | Dataset |
| The ADJSAAM dataset for 3He2H+ | 2020-07-25 | Dataset |
| The ADJSAAM dataset for 3He1H+ | 2020-07-25 | Dataset |
| The ADJSAAM dataset for 1H2H+ | 2020-07-25 | Dataset |
| The ADJSAAM dataset for 4He2H+ | 2020-07-25 | Dataset |
| The ADJSAAM dataset for 4He1H+ | 2020-07-25 | Dataset |
| The eXeL dataset for 1H316O+ | 2020-07-07 | Dataset |
| The Zak dataset for 17O13C18O | 2020-06-30 | Dataset |
| The Zak dataset for 17O12C18O | 2020-06-30 | Dataset |
| The Zak dataset for 16O13C18O | 2020-06-30 | Dataset |
| The Zak dataset for 16O13C17O | 2020-06-30 | Dataset |
| The Zak dataset for 16O12C18O | 2020-06-30 | Dataset |
| The Zak dataset for 16O12C17O | 2020-06-30 | Dataset |
| The UCL-4000 dataset for 12C16O2 | 2020-06-30 | Dataset |
| The 8states dataset for 12C2 | 2020-06-28 | Dataset |
| The OYT3 dataset for 28Si16O2 | 2020-02-01 | Dataset |
| The CATS dataset for 28Si1H2 | 2020-02-01 | Dataset |
| The aCeTY dataset for 12C21H2 | 2020-01-15 | Dataset |
| The MoLLIST dataset for 40Ca1H | 2019-12-10 | Dataset |
| The Coxon-Hajig dataset for 1H19F | 2019-10-05 | Dataset |
| The RACPPK dataset for 1H2H | 2019-10-02 | Dataset |
| The WCCRMT dataset for 14N2 | 2019-09-16 | Dataset |
| The GYT dataset for 36S1H | 2019-08-01 | Dataset |
| The GYT dataset for 34S1H | 2019-08-01 | Dataset |
| The GYT dataset for 33S1H | 2019-08-01 | Dataset |
| The GYT dataset for 32S2H | 2019-08-01 | Dataset |
| The GYT dataset for 32S1H | 2019-08-01 | Dataset |
| The Li2015 dataset for 13C18O | 2019-07-22 | Dataset |
| The Li2015 dataset for 13C17O | 2019-07-22 | Dataset |
| The Li2015 dataset for 12C18O | 2019-07-22 | Dataset |
| The Li2015 dataset for 12C17O | 2019-07-22 | Dataset |
| The ADJSAAM dataset for 1H2 | 2019-06-26 | Dataset |
| The Toto dataset for 50Ti16O | 2019-05-14 | Dataset |
| The Toto dataset for 49Ti16O | 2019-05-14 | Dataset |
| The Toto dataset for 47Ti16O | 2019-05-14 | Dataset |
| The Toto dataset for 46Ti16O | 2019-05-14 | Dataset |
| The AYYJ dataset for 12C1H3 | 2019-05-01 | Dataset |
| The SSYT dataset for 89Y16O | 2019-05-01 | Dataset |
| The LaTY dataset for 31P1H | 2019-04-27 | Dataset |
| The OY-Trans dataset for trans-31P21H2H | 2019-04-01 | Dataset |
| The OY-Trans dataset for trans-31P21H2 | 2019-04-01 | Dataset |
| The OY-Cis dataset for cis-31P21H2 | 2019-04-01 | Dataset |
| The LiTY dataset for 26Mg16O | 2019-04-01 | Dataset |
| The LiTY dataset for 25Mg16O | 2019-04-01 | Dataset |
| The LiTY dataset for 24Mg18O | 2019-04-01 | Dataset |
| The LiTY dataset for 24Mg17O | 2019-04-01 | Dataset |
| The LiTY dataset for 24Mg16O | 2019-04-01 | Dataset |
| The MCYTY dataset for 31P19F3 | 2019-03-14 | Dataset |
| The MoLLIST dataset for 12C1H | 2019-02-14 | Dataset |
| The CYT18 dataset for 75As1H3 | 2018-11-13 | Dataset |
| The MoLLIST dataset for 14N1H | 2018-07-24 | Dataset |
| The MoLLIST dataset for 16O1H | 2018-07-19 | Dataset |
| The MoLLIST dataset for 16O1H+ | 2018-07-19 | Dataset |
| The MoLLIST dataset for 26Mg19F | 2018-07-16 | Dataset |
| The MoLLIST dataset for 25Mg19F | 2018-07-16 | Dataset |
| The MoLLIST dataset for 24Mg19F | 2018-07-16 | Dataset |
| The MoLLIST dataset for 41K19F | 2018-07-16 | Dataset |
| The MoLLIST dataset for 39K19F | 2018-07-16 | Dataset |
| The MoLLIST dataset for 23Na19F | 2018-07-13 | Dataset |
| The MoLLIST dataset for 48Ca19F | 2018-07-13 | Dataset |
| The MoLLIST dataset for 46Ca19F | 2018-07-13 | Dataset |
| The MoLLIST dataset for 44Ca19F | 2018-07-13 | Dataset |
| The MoLLIST dataset for 43Ca19F | 2018-07-13 | Dataset |
| The MoLLIST dataset for 42Ca19F | 2018-07-13 | Dataset |
| The MoLLIST dataset for 40Ca19F | 2018-07-13 | Dataset |
| The MoLLIST dataset for 27Al19F | 2018-07-13 | Dataset |
| The MoLLIST dataset for 27Al37Cl | 2018-07-13 | Dataset |
| The MoLLIST dataset for 27Al35Cl | 2018-07-13 | Dataset |
| The MoLLIST dataset for 7Li37Cl | 2018-07-09 | Dataset |
| The MoLLIST dataset for 7Li35Cl | 2018-07-09 | Dataset |
| The MoLLIST dataset for 6Li37Cl | 2018-07-09 | Dataset |
| The MoLLIST dataset for 6Li35Cl | 2018-07-09 | Dataset |
| The MoLLIST dataset for 7Li19F | 2018-07-06 | Dataset |
| The MoLLIST dataset for 6Li19F | 2018-07-06 | Dataset |
| The OYT dataset for 12C1H337Cl | 2018-06-01 | Dataset |
| The OYT dataset for 12C1H335Cl | 2018-06-01 | Dataset |
| The UCTY dataset for 30Si36S | 2018-06-01 | Dataset |
| The UCTY dataset for 30Si34S | 2018-06-01 | Dataset |
| The UCTY dataset for 30Si33S | 2018-06-01 | Dataset |
| The UCTY dataset for 30Si32S | 2018-06-01 | Dataset |
| The UCTY dataset for 29Si36S | 2018-06-01 | Dataset |
| The UCTY dataset for 29Si34S | 2018-06-01 | Dataset |
| The UCTY dataset for 29Si33S | 2018-06-01 | Dataset |
| The UCTY dataset for 29Si32S | 2018-06-01 | Dataset |
| The UCTY dataset for 28Si36S | 2018-06-01 | Dataset |
| The UCTY dataset for 28Si34S | 2018-06-01 | Dataset |
| The UCTY dataset for 28Si33S | 2018-06-01 | Dataset |
| The UCTY dataset for 28Si32S | 2018-06-01 | Dataset |
| The AlHambra dataset for 26Al1H | 2018-05-15 | Dataset |
| The AlHambra dataset for 27Al1H | 2018-05-15 | Dataset |
| The AlHambra dataset for 27Al2H | 2018-05-15 | Dataset |
| The MaYTY dataset for 12C21H4 | 2018-05-14 | Dataset |
| The POKAZATEL dataset for 1H216O | 2018-05-01 | Dataset |
| The OYKYT dataset for 12C1H319F | 2018-04-01 | Dataset |
| The Zak dataset for 14C16O2 | 2018-02-23 | Dataset |
| The Zak dataset for 13C18O2 | 2018-02-23 | Dataset |
| The Zak dataset for 13C17O2 | 2018-02-23 | Dataset |
| The Zak dataset for 13C16O2 | 2018-02-23 | Dataset |
| The Zak dataset for 12C18O2 | 2018-02-23 | Dataset |
| The Zak dataset for 12C17O2 | 2018-02-23 | Dataset |
| The Darby-Lewis dataset for 9Be1H | 2018-02-12 | Dataset |
| The Darby-Lewis dataset for 9Be2H | 2018-02-12 | Dataset |
| The Darby-Lewis dataset for 9Be3H | 2018-02-12 | Dataset |
| The YT34to10 dataset for 12C1H4 | 2018-01-31 | Dataset |
| The SNaSH dataset for 15N32S | 2018-01-01 | Dataset |
| The SNaSH dataset for 14N36S | 2018-01-01 | Dataset |
| The SNaSH dataset for 14N34S | 2018-01-01 | Dataset |
| The SNaSH dataset for 14N33S | 2018-01-01 | Dataset |
| The SNaSH dataset for 14N32S | 2018-01-01 | Dataset |
| GPU accelerated intensities MPI (GAIN-MPI): a new method of computing Einstein-\(A\) coefficients | 2017-12-20 | Paper |
| The SiGHTLY dataset for 30Si1H | 2017-11-01 | Dataset |
| The SiGHTLY dataset for 29Si1H | 2017-11-01 | Dataset |
| The SiGHTLY dataset for 28Si2H | 2017-11-01 | Dataset |
| The SiGHTLY dataset for 28Si1H | 2017-11-01 | Dataset |
| The POPS dataset for 31P16O | 2017-09-10 | Dataset |
| The POPS dataset for 31P32S | 2017-09-10 | Dataset |
| The MiZATeP dataset for 1H3+ | 2017-03-30 | Dataset |
| The OY2T dataset for 28Si1H4 | 2017-01-31 | Dataset |
| The SAlTY dataset for 31P1H3 | 2017-01-31 | Dataset |
| The ExoAmes dataset for 32S16O2 | 2017-01-31 | Dataset |
| The UYT2 dataset for 32S16O3 | 2017-01-07 | Dataset |
| The Li2015 dataset for 13C16O | 2017-01-01 | Dataset |
| The Li2015 dataset for 12C16O | 2017-01-01 | Dataset |
| The HotWat78 dataset for 1H218O | 2016-12-22 | Dataset |
| The HotWat78 dataset for 1H217O | 2016-12-22 | Dataset |
| The AYTY dataset for 1H212C16O | 2016-12-05 | Dataset |
| The Harris dataset for 1H12C14N | 2016-12-05 | Dataset |
| The CLT dataset for 7Li1H | 2016-09-27 | Dataset |
| The Rivlin dataset for 23Na1H | 2016-08-04 | Dataset |
| The Rivlin dataset for 23Na2H | 2016-08-04 | Dataset |
| The BYTe-15 dataset for 15N1H3 | 2016-07-26 | Dataset |
| The AIJS dataset for 1H14N16O3 | 2016-07-26 | Dataset |
| The APTY dataset for 1H216O2 | 2016-07-26 | Dataset |
| The AYT2 dataset for 1H232S | 2016-07-26 | Dataset |
| The VTT dataset for 1H2H16O | 2016-07-26 | Dataset |
| The VOMYT dataset for 51V16O | 2016-07-26 | Dataset |
| The EBJT dataset for 30Si16O | 2016-07-26 | Dataset |
| The EBJT dataset for 29Si16O | 2016-07-26 | Dataset |
| The EBJT dataset for 28Si18O | 2016-07-26 | Dataset |
| The EBJT dataset for 28Si17O | 2016-07-26 | Dataset |
| The EBJT dataset for 28Si16O | 2016-07-26 | Dataset |
| The VBATHY dataset for 40Ca16O | 2016-07-26 | Dataset |
| The MoLLIST dataset for 13C1H | 2016-07-26 | Dataset |
| The MoLLIST dataset for 52Cr1H | 2016-07-26 | Dataset |
| The MoLLIST dataset for 56Fe1H | 2016-07-26 | Dataset |
| The MoLLIST dataset for 24Mg1H | 2016-07-26 | Dataset |
| The Yadin dataset for 25Mg1H | 2016-07-26 | Dataset |
| The Yadin dataset for 26Mg1H | 2016-07-26 | Dataset |
| The LYT dataset for 45Sc1H | 2016-07-26 | Dataset |
| The MoLLIST dataset for 48Ti1H | 2016-07-26 | Dataset |
| The YYLT dataset for 31P15N | 2016-07-26 | Dataset |
| The YYLT dataset for 31P14N | 2016-07-26 | Dataset |
| The Barton dataset for 23Na37Cl | 2016-07-26 | Dataset |
| The Barton dataset for 23Na35Cl | 2016-07-26 | Dataset |
| The Barton dataset for 41K37Cl | 2016-07-26 | Dataset |
| The Barton dataset for 41K35Cl | 2016-07-26 | Dataset |
| The Barton dataset for 39K37Cl | 2016-07-26 | Dataset |
| The Barton dataset for 39K35Cl | 2016-07-26 | Dataset |
| The JnK dataset for 13C36S | 2016-07-26 | Dataset |
| The JnK dataset for 13C34S | 2016-07-26 | Dataset |
| The JnK dataset for 13C33S | 2016-07-26 | Dataset |
| The JnK dataset for 13C32S | 2016-07-26 | Dataset |
| The JnK dataset for 12C36S | 2016-07-26 | Dataset |
| The JnK dataset for 12C34S | 2016-07-26 | Dataset |
| The JnK dataset for 12C33S | 2016-07-26 | Dataset |
| The JnK dataset for 12C32S | 2016-07-26 | Dataset |
| The MoLLIST dataset for 12C31P | 2016-07-26 | Dataset |
| The CLT dataset for 7Li1H+ | 2016-07-26 | Dataset |
| WATERWAVES: wave particles dynamics on a complex triatomic potential | 2010-10-18 | Paper |
| Effective computation of matrix elements between polynomial basis functions | 2010-10-18 | Paper |
| ROTIONS: A program for the calculation of rotational excitation cross sections in electron-molecular ion collisions | 2003-03-19 | Paper |
| GTOBAS: Fitting continuum functions with Gaussian-type orbitals | 2002-09-02 | Paper |
| Bound and quasi-bound rotation-vibrational states using massively parallel computers | 2002-04-15 | Paper |
| Rotation-vibration calculations using massively parallel computers | 2000-02-01 | Paper |
