15 Publikationen

Alle markieren

[15]
2013 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2622296
Koch, Volker, and Andrae, Dirk. 2013. “Static electric dipole polarizabilities for isoelectronic sequences. II. Open-shell S states”. The European Physical Journal D 67 (7).
PUB | DOI | WoS
 
[14]
2011 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2003194
Koch, Volker, and Andrae, Dirk. 2011. “Static Electric Dipole Polarizabilities for Isoelectronic Sequences”. International Journal of Quantum Chemistry 111 (4): 891-903.
PUB | DOI | WoS
 
[13]
2008 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1588425
Brodbeck, Ralf, Tönsing, Thorsten, Andrae, Dirk, and Volkmer, Dirk. 2008. “Molecular dynamics simulations of dendrimer-encapsulated alpha-keggin ions in trichloromethane solution”. JOURNAL OF PHYSICAL CHEMISTRY B 112 (16): 5153-5162.
PUB | DOI | WoS | PubMed | Europe PMC
 
[12]
2006 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1598770
Andrae, Dirk. 2006. “Molecular knots, links, and fabrics: prediction of existence and suggestion of a synthetic route”. NEW JOURNAL OF CHEMISTRY 30 (6): 873-882.
PUB | DOI | WoS
 
[11]
2005 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1601918
Koch, V, and Andrae, Dirk. 2005. “Discrete contributions to static dipole polarizabilities of excited bound states of non-relativistic hydrogen-like atoms”. THEORETICAL CHEMISTRY ACCOUNTS 114 (4-5): 380-386.
PUB | DOI | WoS
 
[10]
2004 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1605549
Scott, TC, Aubert-Frecon, M, Hadinger, G, Andrae, Dirk, Grotendorst, J, and Morgan, JD. 2004. “Asymptotically exact calculation of the exchange energies of one-active-electron diatomic ions with the surface integral method”. JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS 37 (22): 4451-4469.
PUB | DOI | WoS
 
[9]
2004 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1606337
Scott, TC, Aubert-Frecon, M, Andrae, Dirk, Grotendorst, J, Morgan, JD, and Glasser, ML. 2004. “Exchange energy for two-active-electron diatomic systems within the surface integral method”. APPLICABLE ALGEBRA IN ENGINEERING COMMUNICATION AND COMPUTING 15 (2): 101-128.
PUB | DOI | WoS
 
[8]
2002 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1613621
Scott, TC, Aubert-Frecon, M, and Andrae, Dirk. 2002. “Asymptotics of quantum mechanical atom-ion systems”. APPLICABLE ALGEBRA IN ENGINEERING COMMUNICATION AND COMPUTING 13 (3): 233-255.
PUB | DOI | WoS
 
[7]
2001 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1617372
Andrae, Dirk, Brodbeck, R, and Hinze, J. 2001. “Examination of several density functionals in numerical Kohn-Sham calculations for atoms”. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 82 (5): 227-241.
PUB | DOI | WoS
 
[6]
2001 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1617967
Andrae, Dirk. 2001. “Numerical self-consistent field method for polyatomic molecules”. MOLECULAR PHYSICS 99 (4): 327-334.
PUB | DOI | WoS
 
[5]
2000 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1620833
Andrae, Dirk, Reiher, M, and Hinze, J. 2000. “Numerical electronic structure calculations for atoms. II. Generalized variable transformation and relativistic calculations”. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 76 (4): 473-499.
PUB | DOI | WoS
 
[4]
2000 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1620104
Andrae, Dirk, Reiher, M, and Hinze, J. 2000. “A comparative study of finite nucleus models far low-lying states of few-electron high-Z atoms”. CHEMICAL PHYSICS LETTERS 320 (5-6): 457-468.
PUB | DOI | WoS
 
[3]
2000 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1618989
Andrae, Dirk. 2000. “Finite nuclear charge density distributions in electronic structure calculations for atoms and molecules”. PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS 336 (6): 413-525.
PUB | DOI | WoS
 
[2]
1997 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1627292
Andrae, Dirk. 1997. “Recursive evaluation of expectation values (r(k)) for arbitrary states of the relativistic one-electron atom”. JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS 30 (20): 4435-4451.
PUB | DOI | WoS
 
[1]
1997 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1637328
Andrae, Dirk, and Hinze, J. 1997. “Numerical electronic structure calculations for atoms .1. Generalized variable transformation and nonrelativistic calculations”. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 63 (1): 65-91.
PUB | WoS
 

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15 Publikationen

Alle markieren

[15]
2013 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2622296
Koch, Volker, and Andrae, Dirk. 2013. “Static electric dipole polarizabilities for isoelectronic sequences. II. Open-shell S states”. The European Physical Journal D 67 (7).
PUB | DOI | WoS
 
[14]
2011 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2003194
Koch, Volker, and Andrae, Dirk. 2011. “Static Electric Dipole Polarizabilities for Isoelectronic Sequences”. International Journal of Quantum Chemistry 111 (4): 891-903.
PUB | DOI | WoS
 
[13]
2008 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1588425
Brodbeck, Ralf, Tönsing, Thorsten, Andrae, Dirk, and Volkmer, Dirk. 2008. “Molecular dynamics simulations of dendrimer-encapsulated alpha-keggin ions in trichloromethane solution”. JOURNAL OF PHYSICAL CHEMISTRY B 112 (16): 5153-5162.
PUB | DOI | WoS | PubMed | Europe PMC
 
[12]
2006 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1598770
Andrae, Dirk. 2006. “Molecular knots, links, and fabrics: prediction of existence and suggestion of a synthetic route”. NEW JOURNAL OF CHEMISTRY 30 (6): 873-882.
PUB | DOI | WoS
 
[11]
2005 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1601918
Koch, V, and Andrae, Dirk. 2005. “Discrete contributions to static dipole polarizabilities of excited bound states of non-relativistic hydrogen-like atoms”. THEORETICAL CHEMISTRY ACCOUNTS 114 (4-5): 380-386.
PUB | DOI | WoS
 
[10]
2004 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1605549
Scott, TC, Aubert-Frecon, M, Hadinger, G, Andrae, Dirk, Grotendorst, J, and Morgan, JD. 2004. “Asymptotically exact calculation of the exchange energies of one-active-electron diatomic ions with the surface integral method”. JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS 37 (22): 4451-4469.
PUB | DOI | WoS
 
[9]
2004 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1606337
Scott, TC, Aubert-Frecon, M, Andrae, Dirk, Grotendorst, J, Morgan, JD, and Glasser, ML. 2004. “Exchange energy for two-active-electron diatomic systems within the surface integral method”. APPLICABLE ALGEBRA IN ENGINEERING COMMUNICATION AND COMPUTING 15 (2): 101-128.
PUB | DOI | WoS
 
[8]
2002 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1613621
Scott, TC, Aubert-Frecon, M, and Andrae, Dirk. 2002. “Asymptotics of quantum mechanical atom-ion systems”. APPLICABLE ALGEBRA IN ENGINEERING COMMUNICATION AND COMPUTING 13 (3): 233-255.
PUB | DOI | WoS
 
[7]
2001 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1617372
Andrae, Dirk, Brodbeck, R, and Hinze, J. 2001. “Examination of several density functionals in numerical Kohn-Sham calculations for atoms”. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 82 (5): 227-241.
PUB | DOI | WoS
 
[6]
2001 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1617967
Andrae, Dirk. 2001. “Numerical self-consistent field method for polyatomic molecules”. MOLECULAR PHYSICS 99 (4): 327-334.
PUB | DOI | WoS
 
[5]
2000 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1620833
Andrae, Dirk, Reiher, M, and Hinze, J. 2000. “Numerical electronic structure calculations for atoms. II. Generalized variable transformation and relativistic calculations”. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 76 (4): 473-499.
PUB | DOI | WoS
 
[4]
2000 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1620104
Andrae, Dirk, Reiher, M, and Hinze, J. 2000. “A comparative study of finite nucleus models far low-lying states of few-electron high-Z atoms”. CHEMICAL PHYSICS LETTERS 320 (5-6): 457-468.
PUB | DOI | WoS
 
[3]
2000 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1618989
Andrae, Dirk. 2000. “Finite nuclear charge density distributions in electronic structure calculations for atoms and molecules”. PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS 336 (6): 413-525.
PUB | DOI | WoS
 
[2]
1997 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1627292
Andrae, Dirk. 1997. “Recursive evaluation of expectation values (r(k)) for arbitrary states of the relativistic one-electron atom”. JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS 30 (20): 4435-4451.
PUB | DOI | WoS
 
[1]
1997 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1637328
Andrae, Dirk, and Hinze, J. 1997. “Numerical electronic structure calculations for atoms .1. Generalized variable transformation and nonrelativistic calculations”. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 63 (1): 65-91.
PUB | WoS
 

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Publikationen filtern

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Zitationsstil: chicago

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