15 Publikationen

Alle markieren

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

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15 Publikationen

Alle markieren

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

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Zitationsstil: ama

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