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2022

Journal Article

Machine learning in industrial control system (ICS) security: current landscape, opportunities and challenges

Koay, Abigail M. Y., Ko, Ryan K. L, Hettema, Hinne and Radke, Kenneth (2022). Machine learning in industrial control system (ICS) security: current landscape, opportunities and challenges. Journal of Intelligent Information Systems, 60 (2), 1-29. doi: 10.1007/s10844-022-00753-1

Machine learning in industrial control system (ICS) security: current landscape, opportunities and challenges

2021

Journal Article

Rationality constraints in cyber defense: incident handling, attribution and cyber threat intelligence

Hettema, Hinne (2021). Rationality constraints in cyber defense: incident handling, attribution and cyber threat intelligence. Computers and Security, 109 102396, 1-13. doi: 10.1016/j.cose.2021.102396

Rationality constraints in cyber defense: incident handling, attribution and cyber threat intelligence

2014

Journal Article

Linking chemistry with physics: a reply to Lombardi

Hettema, Hinne (2014). Linking chemistry with physics: a reply to Lombardi. Foundations of Chemistry, 16 (3), 193-200. doi: 10.1007/s10698-014-9200-1

Linking chemistry with physics: a reply to Lombardi

2014

Journal Article

The Dalton quantum chemistry program system

Aidas, Kestutis, Angeli, Celestino, Bak, Keld L., Bakken, Vebjorn, Bast, Radovan, Boman, Linus, Christiansen, Ove, Cimiraglia, Renzo, Coriani, Sonia, Dahle, Pal, Dalskov, Erik K., Ekstrom, Ulf, Enevoldsen, Thomas, Eriksen, Janus J., Ettenhuber, Patrick, Fernandez, Berta, Ferrighi, Lara, Fliegl, Heike, Frediani, Luca, Hald, Kasper, Halkier, Asger, Hattig, Christof, Heiberg, Hanne, Helgaker, Trygve, Hennum, Alf Christian, Hettema, Hinne, Hjertenaes, Eirik, Host, Stinne, Hoyvik, Ida-Marie ... Agren, Hans (2014). The Dalton quantum chemistry program system. Wiley Interdisciplinary Reviews. Computational Molecular Science, 4 (3), 269-284. doi: 10.1002/wcms.1172

The Dalton quantum chemistry program system

2013

Journal Article

QTAIM as a research programme: a reply to Shahbazian

Hettema, Hinne (2013). QTAIM as a research programme: a reply to Shahbazian. Foundations of Chemistry, 15 (3), 335-341. doi: 10.1007/s10698-013-9193-1

QTAIM as a research programme: a reply to Shahbazian

2013

Journal Article

Austere quantum mechanics as a reductive basis for chemistry

Hettema, Hinne (2013). Austere quantum mechanics as a reductive basis for chemistry. Foundations of Chemistry, 15 (3), 311-326. doi: 10.1007/s10698-012-9173-x

Austere quantum mechanics as a reductive basis for chemistry

2012

Journal Article

The unity of chemistry and physics: absolute reaction rate theory

Hettema, Hinne (2012). The unity of chemistry and physics: absolute reaction rate theory. Hyle, 18 (2), 145-173.

The unity of chemistry and physics: absolute reaction rate theory

2009

Journal Article

Explanation and theory formation in quantum chemistry

Hettema, Hinne (2009). Explanation and theory formation in quantum chemistry. Foundations of Chemistry, 11 (3), 145-174. doi: 10.1007/s10698-009-9075-8

Explanation and theory formation in quantum chemistry

2008

Journal Article

A note on Michael Weisberg's: Challenges to the structural conception of chemical bonding

Hettema, Hinne (2008). A note on Michael Weisberg's: Challenges to the structural conception of chemical bonding. Foundations of Chemistry, 10 (2), 135-142. doi: 10.1007/s10698-008-9045-6

A note on Michael Weisberg's: Challenges to the structural conception of chemical bonding

1997

Journal Article

The thermal decomposition of haloacetic acids: A laser pyrolysis and semiempirical study

Hettema, Hinne, Hore, Nathan R., Renner, Noel D. and Russell, Douglas K. (1997). The thermal decomposition of haloacetic acids: A laser pyrolysis and semiempirical study. Australian Journal of Chemistry, 50 (4), 363-372.

The thermal decomposition of haloacetic acids: A laser pyrolysis and semiempirical study

1996

Journal Article

The direct Monte Carlo method applied to the homogeneous nucleation problem

Hettema, Hinne and McFeaters, John S. (1996). The direct Monte Carlo method applied to the homogeneous nucleation problem. Journal of Chemical Physics, 105 (7), 2816-2827. doi: 10.1063/1.472144

The direct Monte Carlo method applied to the homogeneous nucleation problem

1995

Journal Article

On the role of conical intersections in photodissociation. III. the case of hydroxylamine

Hettema, Hinne and Yarkony, David R. (1995). On the role of conical intersections in photodissociation. III. the case of hydroxylamine. The Journal of Chemical Physics, 102 (21), 8431-8439. doi: 10.1063/1.468834

On the role of conical intersections in photodissociation. III. the case of hydroxylamine

1995

Journal Article

Bohr's theory of the atom 1913-1923: A case study in the progress of scientific research programmes

Hettema, Hinne (1995). Bohr's theory of the atom 1913-1923: A case study in the progress of scientific research programmes. Studies in History and Philosophy of Modern Physics, 26 (3), 307-323. doi: 10.1016/1355-2198(95)00018-6

Bohr's theory of the atom 1913-1923: A case study in the progress of scientific research programmes

1995

Journal Article

Radiationless decay of the 1,2,3 3Πg states of Al2: A fully first principles treatment using adiabatic and rigorous diabatic states

Han, Seungsuk, Hettema, Hinne and Yarkony, David R. (1995). Radiationless decay of the 1,2,3 3Πg states of Al2: A fully first principles treatment using adiabatic and rigorous diabatic states. The Journal of Chemical Physics, 102 (5), 1955-1964. doi: 10.1063/1.468762

Radiationless decay of the 1,2,3 3Πg states of Al2: A fully first principles treatment using adiabatic and rigorous diabatic states

1994

Journal Article

A theoretical treatment of the radiative decay of the (a3.PI., v, N, Fi, e/f) levels of BH

Pederson, Lisa A., Hettema, Hinne and Yarkony, David R. (1994). A theoretical treatment of the radiative decay of the (a3.PI., v, N, Fi, e/f) levels of BH. The Journal of Physical Chemistry, 98 (43), 11069-11074. doi: 10.1021/j100094a014

A theoretical treatment of the radiative decay of the (a3.PI., v, N, Fi, e/f) levels of BH

1994

Journal Article

Frequency-dependent polarizabilities of O2 and van der Waals coefficients of dimers containing O2

Hettema, H., Wormer, P. E.S., Jørgensen, P., Jensen, H. J.Aa and Helgaker, T. (1994). Frequency-dependent polarizabilities of O2 and van der Waals coefficients of dimers containing O2. The Journal of Chemical Physics, 100 (2), 1297-1302. doi: 10.1063/1.467256

Frequency-dependent polarizabilities of O2 and van der Waals coefficients of dimers containing O2

1994

Journal Article

On the radiative lifetime of the (a4Σ-,v,N, Fi) levels of the CH radical: An ab initio treatment

Hettema, Hinne and Yarkony, David R. (1994). On the radiative lifetime of the (a4Σ-,v,N, Fi) levels of the CH radical: An ab initio treatment. The Journal of Chemical Physics, 100 (12), 8991-8998. doi: 10.1063/1.466703

On the radiative lifetime of the (a4Σ-,v,N, Fi) levels of the CH radical: An ab initio treatment

1993

Journal Article

Intramolecular bond length dependence of the anisotropic dispersion coefficients for interactions of rare gas atoms with N2, CO, Cl2, HCl and HBr

Hettema, Hinne, Wormer, Paul E. S. and Thakkar, Ajit J. (1993). Intramolecular bond length dependence of the anisotropic dispersion coefficients for interactions of rare gas atoms with N2, CO, Cl2, HCl and HBr. Molecular Physics, 80 (3), 533-548. doi: 10.1080/00268979300102451

Intramolecular bond length dependence of the anisotropic dispersion coefficients for interactions of rare gas atoms with N2, CO, Cl2, HCl and HBr

1993

Journal Article

Frequency-dependent polarizabilities and first hyperpolarizabilities of H2O

Luo, Yi, Ågren, Hans, Vahtras, Olav, Jørgensen, Poul, Spirko, Vladimir and Hettema, Hinne (1993). Frequency-dependent polarizabilities and first hyperpolarizabilities of H2O. The Journal of Chemical Physics, 98 (9), 7159-7164. doi: 10.1063/1.464733

Frequency-dependent polarizabilities and first hyperpolarizabilities of H2O

1993

Journal Article

Intramolecular bond length dependence of the anisotropic dispersion coefficients for H2-rare gas interactions

Wormer, Paul E. S., Hettema, Hinne and Thakkar, Ajit J. (1993). Intramolecular bond length dependence of the anisotropic dispersion coefficients for H2-rare gas interactions. The Journal of Chemical Physics, 98 (9), 7140-7144. doi: 10.1063/1.464757

Intramolecular bond length dependence of the anisotropic dispersion coefficients for H2-rare gas interactions