Aarhus Universitets segl

Publications

2025

Bibliography
(1)
Slavicinska, K.; Boogert, A. C. A.; Tychoniec, Ł.; Dishoeck, E. F. van; Gelder, M. L. van; Navarro, M. G.; Santos, J. C.; Klaassen, P. D.; Kavanagh, P. J.; Chuang, K.-J. Ammonium Hydrosulfide (NH4SH) as a Potentially Significant Sulfur Sink in Interstellar Ices. A&A 2025, 693, A146. https://doi.org/10.1051/0004-6361/202451383.
(2)
Pitfield, J.; Brix, F.; Tang, Z.; Slavensky, A. M.; Rønne, N.; Christiansen, M.-P. V.; Hammer, B. Augmentation of Universal Potentials for Broad Applications. Phys. Rev. Lett. 2025, 134 (5), 056201. https://doi.org/10.1103/PhysRevLett.134.056201.
(3)
Brix, F.; Verner Christiansen, M.-P.; Hammer, B. Cascading Symmetry Constraint during Machine Learning-Enabled Structural Search for Sulfur-Induced Cu(111)-(43×43) Surface Reconstruction. The Journal of Chemical Physics 2024, 160 (17), 174107. https://doi.org/10.1063/5.0201421.
(4)
Temmink, M.; Booth, A. S.; Leemker, M.; Marel, N. van der; Dishoeck, E. F. van; Evans, L.; Keyte, L.; Law, C. J.; Notsu, S.; Öberg, K.; Walsh, C. Characterising the Molecular Line Emission in the Asymmetric Oph-IRS 48 Dust Trap: Temperatures, Timescales, and Sub-Thermal Excitation. A&A 2025, 693, A101. https://doi.org/10.1051/0004-6361/202452175.
(5)
Sellek, A. D.; Vlasblom, M.; Dishoeck, E. F. van. CO2-Rich Protoplanetary Discs as a Probe of Dust Radial Drift and Trapping. A&A 2025, 694, A79. https://doi.org/10.1051/0004-6361/202451137.
(6)
Chen, Y.; Garrod, R. T.; Rachid, M.; Dishoeck, E. F. van; Brogan, C. L.; Loomis, R.; Lipnicky, A.; McGuire, B. A. CoCCoA: Complex Chemistry in Hot Cores with ALMA - The Chemical Evolution of Acetone from Ice to Gas. A&A 2025, 696, A198. https://doi.org/10.1051/0004-6361/202453389.
(7)
Mifsud, D. V.; Kaňuchová, Z.; Auriacombe, O.; Herczku, P.; Qasim, D.; Kovács, S. T. S.; Rácz, R.; Sulik, B.; Juhász, Z.; Rajta, I.; Vajda, I.; Biri, S.; McCullough, R. W.; Ioppolo, S.; Raut, U.; Mason, N. J. Cosmic Ray Irradiation of Interstellar Ices on Sulfur-Rich Grains: A Possible Source of Sulfur-Bearing Molecules. ACS Earth Space Chem. 2025. https://doi.org/10.1021/acsearthspacechem.5c00036.
(8)
Smith, Z. L.; Dickinson, H. J.; Fraser, H. J.; McClure, M. K.; Noble, J. A.; Boogert, A. C. A.; Sun, F.; Egami, E.; Dartois, E.; Erkal, J.; Shimonishi, T.; Beck, T. L.; Bergner, J. B.; Caselli, P.; Charnley, S. B.; Chu, L.; Drozdovskaya, M. N.; Garrod, R.; Harsono, D.; Ioppolo, S.; Jimenez-Serra, I.; Jørgensen, J. K.; Melnick, G. J.; Öberg, K. I.; Palumbo, M. E.; Pendleton, Y. J.; Perotti, G.; Pontoppidan, K. M.; Qasim, D.; Rocha, W. R. M.; Sturm, J. A.; Taillard, A.; Urso, R. G.; van Dishoeck, E. F. Cospatial Ice Mapping of H2O with CO2 and CO across a Molecular Cloud with JWST/NIRCam. Nat Astron 2025, 1–12. https://doi.org/10.1038/s41550-025-02511-z.
(9)
Mifsud, D. V.; Góbi, S.; Herczku, P.; Sulik, B.; Juhász, Z.; Ioppolo, S.; Mason, N. J.; Tarczay, G. Electron Irradiation of Crystalline Nitrous Oxide Ice at Low Temperatures: Applications to Outer Solar System Planetary Science. Low Temperature Physics 2025, 51 (4), 412–425. https://doi.org/10.1063/10.0036117.
(10)
Santos, J. C.; Piacentino, E. L.; Bergner, J. B.; Rajappan, M.; Öberg, K. I. H2S Ice Sublimation Dynamics - Experimentally Constrained Binding Energies, Entrapment Efficiencies, and Snowlines. A&A 2025, 698, A254. https://doi.org/10.1051/0004-6361/202554068.
(11)
Slavicinska, K.; Tychoniec, Ł.; Navarro, M. G.; van Dishoeck, E. F.; Tobin, J. J.; van Gelder, M. L.; Chen, Y.; Boogert, A. C. A.; Drechsler, W. B.; Beuther, H.; Caratti o Garatti, A.; Megeath, S. T.; Klaassen, P.; Looney, L. W.; Kavanagh, P. J.; Brunken, N. G. C.; Sheehan, P.; Fischer, W. J. HDO Ice Detected toward an Isolated Low-Mass Protostar with JWST. ApJL 2025, 986 (2), L19. https://doi.org/10.3847/2041-8213/addb45.
(12)
Maté, B.; Peláez, R. J.; Molpeceres, G.; Rácz, R.; Mifsud, D. V.; Ortigoso, J.; Rivilla, V. M.; Lakatos, G.; Sulik, B.; Herczku, P.; Ioppolo, S.; Biri, S.; Juhász, Z. Hydroxylamine in Astrophysical Ices: Infrared Spectra and Cosmic-Ray-Induced Radiolytic Chemistry. A&A 2025, 695, A102. https://doi.org/10.1051/0004-6361/202453312.
(13)
Schrauwen, J. G. M.; Dijkhuis, T. M.; Ioppolo, S.; Galimberti, D. R.; Redlich, B.; Cuppen, H. M. Infrared Irradiation of H2O:CO2 Ice: A Combined Experimental and Computational Study of the Dissipation of CO2 Vibrational Excitations. ACS Earth Space Chem. 2025. https://doi.org/10.1021/acsearthspacechem.5c00030.
(14)
Kempen, L. H. E.; Andersen, M. Inverse Catalysts: Tuning the Composition and Structure of Oxide Clusters through the Metal Support. npj Comput Mater 2025, 11 (1), 8. https://doi.org/10.1038/s41524-024-01507-z.
(15)
Slumstrup, L.; Thrower, J. D.; Schrauwen, J. G. M.; Lamberts, T.; Ingman, E. R.; Laurinavicius, D.; DeVine, J.; Terwisscha van Scheltinga, J.; Santos, J. C.; Noble, J. A.; Wenzel, G.; McCoustra, M. R. S.; Brown, W. A.; Linnartz, H.; Hornekær, L.; Cuppen, H. M.; Redlich, B.; Ioppolo, S. IR-Induced CO Photodesorption from Pure CO Ice and CO on Amorphous Solid Water. ACS Earth Space Chem. 2025. https://doi.org/10.1021/acsearthspacechem.5c00040.
(16)
Arabhavi, A. M.; Kamp, I.; van Dishoeck, E. F.; Henning, T.; Jang, H.; Christiaens, V.; Gasman, D.; Pascucci, I.; Perotti, G.; Grant, S. L.; Barrado, D.; Güdel, M.; Lagage, P.-O.; Caratti o Garatti, A.; Lahuis, F.; Waters, L. B. F. M.; Kaeufer, T.; Kanwar, J.; Morales-Calderón, M.; Schwarz, K.; Sellek, A. D.; Tabone, B.; Temmink, M.; Vlasblom, M. MINDS: The Very Low-Mass Star and Brown Dwarf Sample Hidden Water in Carbon-Dominated Protoplanetary Disks. ApJL 2025, 984 (2), L62. https://doi.org/10.3847/2041-8213/adc692.
(17)
Temmink, M.; Sellek, D. A.; Gasman, D.; Dishoeck, F. E. van; Vlasblom, M.; Pranger, A.; G"udel, M.; Henning, T.; Lagage, P.-O.; Garatti, A. C. o; Kamp, I.; Olofsson, G.; Arabhavi, M. A.; Grant, L. S.; Kaeufer, T.; Kurtovic, T. N.; Perotti, G.; Samland, M.; Schwarz, K.; Tabone, B. MINDS: Water Reservoirs of Compact Planet-Forming Dust Discs. A Diversity of H_2O Distributions. A&A 2025. https://doi.org/10.1051/0004-6361/202554213.
(18)
Schwarz, K. R.; Samland, M.; Olofsson, G.; Henning, T.; Sellek, A.; Güdel, M.; Tabone, B.; Kamp, I.; Lagage, P.-O.; van Dishoeck, E. F.; Caratti o Garatti, A.; Glauser, A. M.; Ray, T. P.; Arabhavi, A. M.; Christiaens, V.; Franceschi, R.; Gasman, D.; Grant, S. L.; Kanwar, J.; Kaeufer, T.; Kurtovic, N. T.; Perotti, G.; Temmink, M.; Vlasblom, M. MINDS. JWST-MIRI Observations of a Spatially Resolved Atomic Jet and Polychromatic Molecular Wind toward SY Cha. ApJ 2025, 980 (1), 148. https://doi.org/10.3847/1538-4357/adaa79.
(19)
Vlasblom, M.; Temmink, M.; Grant, S. L.; Kurtovic, N.; Sellek, A. D.; Dishoeck, E. F. van; Güdel, M.; Henning, T.; Lagage, P.-O.; Barrado, D.; Garatti, A. C. o; Glauser, A. M.; Kamp, I.; Lahuis, F.; Olofsson, G.; Arabhavi, A. M.; Christiaens, V.; Gasman, D.; Jang, H.; Morales-Calderón, M.; Perotti, G.; Schwarz, K.; Tabone, B. MINDS. JWST-MIRI Reveals a Peculiar CO2-Rich Chemistry in the Drift-Dominated Disk CX Tau. A&A 2025, 693, A278. https://doi.org/10.1051/0004-6361/202450863.
(20)
Friis Holleufer, S.; T. Hopkinson, A.; S. Sutherland, D.; Li, Z.; V. Lauritsen, J.; Hornekaer, L.; Cassidy, A. Silicon Oxide Nanoparticles Grown on Graphite by Co-Deposition of the Atomic Constituents. Physical Chemistry Chemical Physics 2025, 27 (26), 13906–13916. https://doi.org/10.1039/D5CP01089F.
(21)
Cheula, R.; Andersen, M. Transition States Energies from Machine Learning: An Application to Reverse Water–Gas Shift on Single-Atom Alloys. ACS Catal. 2025, 11377–11388. https://doi.org/10.1021/acscatal.5c02818.
(22)
Mikkelsen, N. M.; Lamberts, T.; Andersen, M. Trends in Structure and IR Spectra of Mixed H2O/CO2 Ices of Astrochemical Relevance. ACS Earth Space Chem. 2025, 9 (3), 627–637. https://doi.org/10.1021/acsearthspacechem.4c00353.
(23)
Le Gouellec, V. J. M.; Lew, B. W. P.; Greene, T. P.; Johnstone, D.; Gusdorf, A.; Francis, L.; DeWitt, C.; Meyer, M.; Tychoniec, Ł.; van Dishoeck, E. F.; Barsony, M.; Hodapp, K. W.; Martin, P. G.; Robberto, M. Unveiling Two Deeply Embedded Young Protostars in the S68N Class 0 Protostellar Core with JWST/NIRSpec. ApJ 2025, 985 (2), 225. https://doi.org/10.3847/1538-4357/adcac4.
(24)
Doktor, F. G.; Mikkelsen, N. M.; Kyrkjebo̷, S.; Srivastava, P.; Balog, R.; Hammer, B.; Morgenstern, K.; Hornekær, L. Water Nucleation via Transient Bonds to Oxygen-Functionalized Graphite. J. Phys. Chem. C 2025, 129 (11), 5718–5727. https://doi.org/10.1021/acs.jpcc.4c08614.

2024

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Outside PURE

Rønne, Nikolaj, et al., Generative diffusion model for surface structure discovery Physical Review B (2024) 10.1103/PhysRevB.110.235427

Christiansen, Mads-Peter Verner, et al., Efficient ensemble uncertainty estimation in Gaussian processes regression Machine Learning: Science and Technology (2024) 10.1088/2632-2153/ad8984

van Gelder, M. L., et al., JWST Observations of Young protoStars (JOYS): Overview of gaseous molecular emission and absorption in low-mass protostars Astronomy and Astrophysics (2024) 10.1051/0004-6361/202451967

Brunken, N. G. C., et al., JOYS+ study of solid-state <SUP>12</SUP>C/<SUP>13</SUP>C isotope ratios in protostellar envelopes: Observations of CO and CO<SUB>2</SUB> ice with the James Webb Space Telescope Astronomy and Astrophysics (2024) 10.1051/0004-6361/202451794

Bergner, Jennifer B., et al., JWST Ice Band Profiles Reveal Mixed Ice Compositions in the HH 48 NE Disk The Astrophysical Journal (2024) 10.3847/1538-4357/ad79fc

Schrauwen, J. G. M., et al., The effect of dilution on the energy dissipation in water interstellar ice analogues: Probed by infrared irradiation Astronomy and Astrophysics (2024) 10.1051/0004-6361/202451474

Jang, Hyerin, et al., Dust mineralogy and variability of the inner PDS 70 disk: Insights from JWST/MIRI MRS and Spitzer IRS observations Astronomy and Astrophysics (2024) 10.1051/0004-6361/202451589

Caratti o Garatti, A., et al., JWST Observations of Young protoStars (JOYS): HH211: Textbook case of a protostellar jet and outflow Astronomy and Astrophysics (2024) 10.1051/0004-6361/202451350

Rubinstein, Adam E., et al., IPA: Class 0 Protostars Viewed in CO Emission Using JWST The Astrophysical Journal (2024) 10.3847/1538-4357/ad6b92

Mifsud, Duncan V., et al., A systematic mid-infrared spectroscopic study of thermally processed H<SUB>2</SUB>S ices Spectrochimica Acta Part A: Molecular Spectroscopy (2024) 10.1016/j.saa.2024.124567

Chen, Y., et al., JOYS+: The link between the ice and gas of complex organic molecules: Comparing JWST and ALMA data of two low-mass protostars Astronomy and Astrophysics (2024) 10.1051/0004-6361/202450706

Santos, J. C., et al., Formation of carbonyl sulfide (OCS) via SH radicals in interstellar CO-rich ice under dense cloud conditions Astronomy and Astrophysics (2024) 10.1051/0004-6361/202451368

Rácz, R., et al., AQUILA: A laboratory facility for the irradiation of astrochemical ice analogs by keV ions Review of Scientific Instruments (2024) 10.1063/5.0207967

Noble, J. A., et al., Detection of the elusive dangling OH ice features at 2.7 μm in Chamaeleon I with JWST NIRCam Nature Astronomy (2024) 10.1038/s41550-024-02307-7

Simonsen, Frederik Doktor S., et al., Molecular Hydrogen Formation via Vibrational Excitation of Partially Superhydrogenated Pyrenes The Astrophysical Journal (2024) 10.3847/1538-4357/ad5bd8

Temmink, Milou, et al., MINDS: The DR Tau disk: II. Probing the hot and cold H<SUB>2</SUB>O reservoirs in the JWST-MIRI spectrum Astronomy and Astrophysics (2024) 10.1051/0004-6361/202450355

Santos, Julia C., et al., SO<SUB>2</SUB> and OCS toward high-mass protostars: A comparative study of ice and gas Astronomy and Astrophysics (2024) 10.1051/0004-6361/202450736

Kanwar, Jayatee, et al., MINDS. Hydrocarbons detected by JWST/MIRI in the inner disk of Sz28 consistent with a high C/O gas-phase chemistry Astronomy and Astrophysics (2024) 10.1051/0004-6361/202450078

Sturm, J. A., et al., A JWST/MIRI analysis of the ice distribution and polycyclic aromatic hydrocarbon emission in the protoplanetary disk HH 48 NE Astronomy and Astrophysics (2024) 10.1051/0004-6361/202450865

Grant, Sierra L., et al., MINDS: A multi-instrument investigation into the molecule-rich JWST-MIRI spectrum of the DF Tau binary system Astronomy and Astrophysics (2024) 10.1051/0004-6361/202450768

Slavicinska, Katerina, et al., JWST detections of amorphous and crystalline HDO ice toward massive protostars Astronomy and Astrophysics (2024) 10.1051/0004-6361/202449785

Slavensky, Andreas Møller & Hammer, Bjørk, Accelerating structure search using atomistic graph-based classifiers Journal of Chemical Physics (2024) 10.1063/5.0207801

Nazari, P., et al., Correlations among complex organic molecules around protostars: Effects of physical structure Astronomy and Astrophysics (2024) 10.1051/0004-6361/202347033

Franceschi, Riccardo, et al., MINDS: Mid-infrared atomic and molecular hydrogen lines in the inner disk around a low-mass star Astronomy and Astrophysics (2024) 10.1051/0004-6361/202348034

Tychoniec, Łukasz, et al., JWST Observations of Young protoStars (JOYS). Linked accretion and ejection in a Class I protobinary system Astronomy and Astrophysics (2024) 10.1051/0004-6361/202348889

Chuang, K. -J., et al., Formation of N-bearing complex organic molecules in molecular clouds: Ketenimine, acetonitrile, acetaldimine, and vinylamine via the UV photolysis of C<SUB>2</SUB>H<SUB>2</SUB> ice Astronomy and Astrophysics (2024) 10.1051/0004-6361/202348890

Nazari, P., et al., ALMA view of the L1448-mm protostellar system on disk scales: CH<SUB>3</SUB>OH and H<SUP>13</SUP>CN as new disk wind tracers Astronomy and Astrophysics (2024) 10.1051/0004-6361/202348676

Temmink, Milou, et al., MINDS: The DR Tau disk. I. Combining JWST-MIRI data with high-resolution CO spectra to characterise the hot gas Astronomy and Astrophysics (2024) 10.1051/0004-6361/202348911

Nazari, P., et al., Hunting for complex cyanides in protostellar ices with the JWST. A tentative detection of CH<SUB>3</SUB>CN and C<SUB>2</SUB>H<SUB>5</SUB>CN Astronomy and Astrophysics (2024) 10.1051/0004-6361/202348695

Nazari, P., et al., A deep search for large complex organic species toward IRAS16293-2422 B at 3 mm with ALMA Astronomy and Astrophysics (2024) 10.1051/0004-6361/202347832

Henning, Thomas, et al., MINDS: The JWST MIRI Mid-INfrared Disk Survey Publications of the Astronomical Society of the Pacific (2024) 10.1088/1538-3873/ad3455

Brix, Florian, et al., Cascading symmetry constraint during machine learning-enabled structural search for sulfur-induced Cu(111)-<inline-formula><mml:math display="inline" overflow="scroll"><mml:mrow><mml:mo stretchy="false">(</mml:mo><mml:mrow><mml:msqrt><mml:mrow><mml:mn>43</mml:mn></mml:mrow></mml:msqrt><mml:mo>×</mml:mo><mml:msqrt><mml:mrow><mml:mn>43</mml:mn></mml:mrow></mml:msqrt></mml:mrow><mml:mo stretchy="false">)</mml:mo></mml:mrow></mml:math></inline-formula> surface reconstruction Journal of Chemical Physics (2024) 10.1063/5.0201421

Brunken, Nashanty G. C., et al., JWST observations of <SUP>13</SUP>CO<SUB>2</SUB> ice. Tracing the chemical environment and thermal history of ices in protostellar envelopes Astronomy and Astrophysics (2024) 10.1051/0004-6361/202348718

Dartois, E., et al., Spectroscopic sizing of interstellar icy grains with JWST Nature Astronomy (2024) 10.1038/s41550-023-02155-x

Mifsud, Duncan V., et al., Sulphur ion implantation into O<SUB>2</SUB>, CO, and CO<SUB>2</SUB> ices: Implications for the formation of sulphur-bearing molecules in the Kuiper Belt Icarus (2024) 10.1016/j.icarus.2023.115926

Samarth, P., et al., Pulsed ion deflection to overcome detector saturation in cryogenic ice sampling Review of Scientific Instruments (2024) 10.1063/5.0186448

Schwarz, Kamber R., et al., MINDS. JWST/MIRI Reveals a Dynamic Gas-rich Inner Disk inside the Cavity of SY Cha The Astrophysical Journal (2024) 10.3847/1538-4357/ad1393

van Gelder, M. L., et al., JOYS+: Mid-infrared detection of gas-phase SO<SUB>2</SUB> emission in a low-mass protostar. The case of NGC 1333 IRAS 2A: Hot core or accretion shock? Astronomy and Astrophysics (2024) 10.1051/0004-6361/202348118

Rocha, W. R. M., et al., Water ice: Temperature-dependent refractive indexes and their astrophysical implications Astronomy and Astrophysics (2024) 10.1051/0004-6361/202347437

2023

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Outside PURE

Sturm, J. A., et al., A JWST inventory of protoplanetary disk ices. The edge-on protoplanetary disk HH 48 NE, seen with the Ice Age ERS program Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202347512

Gasman, Danny, et al., MINDS. Abundant water and varying C/O across the disk of Sz 98 as seen by JWST/MIRI Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202347005

Gieser, C., et al., JOYS: Disentangling the warm and cold material in the high-mass IRAS 23385+6053 cluster Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202347060

Ray, T. P., et al., Outflows from the youngest stars are mostly molecular Nature (2023) doi - 10.1038/s41586-023-06551-1

Chuang, K. -J., et al., Interstellar Carbonaceous Dust Erosion Induced by X-Ray Irradiation of Water Ice in Star-forming Regions The Astrophysical Journal (2023) doi - 10.3847/1538-4357/acf31e

Grant, Sierra L., et al., The \dot{M} -M <SUB>disk</SUB> Relationship for Herbig Ae/Be Stars: A Lifetime Problem for Disks with Low Masses? The Astronomical Journal (2023) doi - 10.3847/1538-3881/acf128

Chen, Y., et al., CoCCoA: Complex Chemistry in hot Cores with ALMA. Selected oxygen-bearing species Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202346491

Santos, J. C., et al., Interaction of H2S with H atoms on grain surfaces under molecular cloud conditions Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202347348

Perotti, G., et al., Water in the terrestrial planet-forming zone of the PDS 70 disk Nature (2023) doi - 10.1038/s41586-023-06317-9

Tabone, B., et al., A rich hydrocarbon chemistry and high C to O ratio in the inner disk around a very low-mass star Nature Astronomy (2023) doi - 10.1038/s41550-023-01965-3

Andersen, Mie & Slavensky, Andreas Møller, Descriptors for binding energies at clusters: The case of nanosilicates as models of interstellar dust grains Journal of Chemical Physics (2023) doi - 10.1063/5.0156311

Slavensky, Andreas Møller, et al., Generating candidates in global optimization algorithms using complementary energy landscapes Journal of Chemical Physics (2023) doi - 10.1063/5.0156218

Nazari, Pooneh, et al., Evidence for Ubiquitous Carbon Grain Destruction in Hot Protostellar Envelopes The Astrophysical Journal (2023) doi - 10.3847/2041-8213/acdde4

Tang, Zeyuan, et al., A machine learning potential for simulating infrared spectra of nanosilicate clusters Journal of Chemical Physics (2023) doi - 10.1063/5.0150379

Rasmussen, Anne P., et al., Gas-phase electronic action absorption spectra of protonated oxygen-functionalized polycyclic aromatic hydrocarbons (OPAHs) Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202346003

Beuther, H., et al., JWST Observations of Young protoStars (JOYS). Outflows and accretion in the high-mass star-forming region IRAS 23385+6053 Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202346167

McClure, M. K., et al., An Ice Age JWST inventory of dense molecular cloud ices Nature Astronomy (2023) doi - 10.1038/s41550-022-01875-w

Cassidy, Andrew, et al., Hidden singularities in spontaneously polarized molecular solids Journal of Chemical Physics (2023) doi - 10.1063/5.0138642

Grant, Sierra L., et al., MINDS. The Detection of 13CO2 with JWST-MIRI Indicates Abundant CO2 in a Protoplanetary Disk The Astrophysical Journal (2023) doi - 10.3847/2041-8213/acc44b

Santos, J. C., et al., Resonant infrared irradiation of CO and CH3OH interstellar ices Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202245704

Tobin, John J., et al., Deuterium-enriched water ties planet-forming disks to comets and protostars Nature (2023) doi - 10.1038/s41586-022-05676-z

Leccese, Mirko, et al., Bending the rules of PAH hydrogenation: the case of corannulene Monthly Notices of the Royal Astronomical Society (2023) doi - 10.1093/mnras/stad054

Nazari, P., et al., Importance of source structure on complex organics emission. III. Effect of disks around massive protostars Astronomy and Astrophysics (2023) doi - 10.1051/0004-6361/202244801

2022

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Outside PURE

Yang, Yao-Lun, et al., CORINOS. I. JWST/MIRI Spectroscopy and Imaging of a Class 0 Protostar IRAS 15398-3359 The Astrophysical Journal (2022) 10.3847/2041-8213/aca289

Nazari, P., et al., N-bearing complex organics toward high-mass protostars. Constant ratios pointing to formation in similar pre-stellar conditions across a large mass range Astronomy and Astrophysics (2022) 10.1051/0004-6361/202243788

van Gelder, M. L., et al., Methanol deuteration in high-mass protostars Astronomy and Astrophysics (2022) 10.1051/0004-6361/202244471

Villadsen, T., et al., Predicting binding energies of astrochemically relevant molecules via machine learning Astronomy and Astrophysics (2022) 10.1051/0004-6361/202244091

Christiansen, Mads-Peter V., et al., Atomistic global optimization X: A Python package for optimization of atomistic structures Journal of Chemical Physics (2022) 10.1063/5.0094165

Tang, Zeyuan, et al., Top-down formation of ethylene from fragmentation of superhydrogenated polycyclic aromatic hydrocarbons Astronomy and Astrophysics (2022) 10.1051/0004-6361/202243202

Jaganathan, R., et al., Enhanced reactivity of oxygen-functionalised PAHs with atomic hydrogen - A route to the formation of small oxygen-carrying molecules Astronomy and Astrophysics (2022) 10.1051/0004-6361/202243312

Nazari, P., et al., Importance of source structure on complex organics emission. II. Do disks explain lack of methanol emission from low-mass protostars? Astronomy and Astrophysics (2022) 10.1051/0004-6361/202142777

Leemker, M., et al., Gas temperature structure across transition disk cavities Astronomy and Astrophysics (2022) 10.1051/0004-6361/202243229

Bisbo, Malthe K. & Hammer, Bjørk, Global optimization of atomic structure enhanced by machine learning Physical Review B (2022) 10.1103/PhysRevB.105.245404

Santos, Julia C., et al., First Experimental Confirmation of the CH3O + H2CO → CH3OH + HCO Reaction: Expanding the CH3OH Formation Mechanism in Interstellar Ices. The Astrophysical Journal (2022) 10.3847/2041-8213/ac7158

van Gelder, M. L., et al., Importance of source structure on complex organics emission. I. Observations of CH3OH from low-mass to high-mass protostars Astronomy and Astrophysics (2022) 10.1051/0004-6361/202142769

Tang, Zeyuan & Hammer, Bjørk, Dimerization of dehydrogenated polycyclic aromatic hydrocarbons on graphene Journal of Chemical Physics (2022) 10.1063/5.0083253

Ager Meldgaard, Søren, et al., Generating stable molecules using imitation and reinforcement learning Machine Learning: Science and Technology (2022) 10.1088/2632-2153/ac3eb4

Fedoseev, Gleb, et al., Hydrogenation of Accreting C Atoms and CO Molecules-Simulating Ketene and Acetaldehyde Formation Under Dark and Translucent Cloud Conditions The Astrophysical Journal (2022) 10.3847/1538-4357/ac3834

Outside PURE

P. Nazari et al. Complex organic molecules in low-mass protostars on Solar System scales. II. Nitrogen-bearing species. Astronomy & Astrophysics (2021). https://doi.org/10.1051/0004-6361/202039996

G. Molpeceres et al. Carbon atom reactivity with amorphous solid ater: H2O‑catalyzed formation of H2CO. J. Phys. Chem. Lett. https://doi.org/10.1021/acs.jpclett.1c02760

M.G. Rachid et al. Infrared spectra of complex organic molecules in astronomically relevant ice mixtures IV. Methylamine. Astronomy & Astrophysics (2021) https://doi.org/10.1051/0004-6361/202140782

K.-J. Chuang et al. Formation of complex organic molecules in molecular clouds – acetaldehyde, vinyl alcohol, ketene, and ethanol via energetic" processing of C2H2 ice. Astronomy & Astrophysics (2021). https://doi.org/10.1051/0004-6361/202140780 

M. Bulak et al. Photolysis of acetonitrile in a water-rich ice as a source of complex organic molecules: CH3CN and H2O:CH3CN ices. Astronomy & Astrophysics (2021). https://doi.org/10.1051/0004-6361/202039695

2020

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Outside PURE

M.L. van Gelder et al. Complex organic molecules in low-mass protostars on Solar System scales. I. Oxygen-bearing species. Astron. Astrophys. (2020). https://www.aanda.org/articles/aa/full_html/2020/07/aa37758-20/aa37758-20.html

Ioppolo, S., Fedoseev, G., Chuang, KJ. et al. A non-energetic mechanism for glycine formation in the interstellar medium. Nat Astron (2020). https://doi.org/10.1038/s41550-020-01249-0