| 國立交通大學 |
2019-04-02T06:00:43Z |
When finite becomes infinite: convergence properties of vibrational spectra of oligomer chains
|
Chou, Chien-Pin; Witek, Henryk; Irle, Stephan |
| 國立交通大學 |
2018-08-21T05:52:56Z |
Zhang-Zhang Polynomials of Regular 5-tier Benzenoid Strips
|
Witek, Henryk A.; Langner, Johanna; Mos, Grzegorz; Chou, Chien-Pin |
| 國立交通大學 |
2017-04-21T06:55:48Z |
Automatized Parameterization of DFTB Using Particle Swarm Optimization
|
Chou, Chien-Pin; Nishimura, Yoshifumi; Fan, Chin-Chai; Mazur, Grzegorz; Irle, Stephan; Witek, Henryk A. |
| 國立交通大學 |
2017-04-21T06:55:48Z |
Automatized Parameterization of the Density-functional Tight-binding Method. II. Two-center Integrals
|
Witek, Henryk A.; Chou, Chien-Pin; Mazur, Grzegorz; Nishimura, Yoshifumi; Irle, Stephan; Aradi, Balint; Frauenheim, Thomas; Morokuma, Keiji |
| 國立交通大學 |
2016-03-28T00:04:27Z |
Automatized Parameterization of DFTB Using Particle Swarm Optimization
|
Chou, Chien-Pin; Nishimura, Yoshifumi; Fan, Chin-Chai; Mazur, Grzegorz; Irle, Stephan; Witek, Henryk A. |
| 國立交通大學 |
2016-03-28T00:04:26Z |
Automatized Parameterization of the Density-functional Tight-binding Method. II. Two-center Integrals
|
Witek, Henryk A.; Chou, Chien-Pin; Mazur, Grzegorz; Nishimura, Yoshifumi; Irle, Stephan; Aradi, Balint; Frauenheim, Thomas; Morokuma, Keiji |
| 國立交通大學 |
2016-03-28T00:04:17Z |
Closed-form formulas for the Zhang-Zhang polynomials of benzenoid structures: Prolate rectangles and their generalizations
|
Chou, Chien-Pin; Kang, Jin-Su; Witek, Henryk A. |
| 國立交通大學 |
2015-11-26T00:55:47Z |
應用於數學化學及量子化學之演算法及程式開發
|
周建斌; Chou, Chien-Pin; 魏恆理; Witek, Henryk A. |
| 國立交通大學 |
2015-07-21T08:28:24Z |
Two Examples for the Application of the ZZDecomposer: Zigzag-Edge Coronoids and Fenestrenes
|
Chou, Chien-Pin; Witek, Henryk A. |
| 國立交通大學 |
2015-07-21T08:28:24Z |
Zhang-Zhang Polynomials of Regular 3-and 4-tier Benzenoid Strips
|
Witek, Henryk A.; Mos, Grzegorz; Chou, Chien Pin |
| 國立交通大學 |
2014-12-08T15:36:37Z |
Determination of Zhang-Zhang Polynomials for Various Classes of Benzenoid Systems: Non-Heuristic Approach
|
Chou, Chien-Pin; Witek, Henryk A. |
| 國立交通大學 |
2014-12-08T15:36:37Z |
Closed-Form Formulas for the Zhang-Zhang Polynomials of Benzenoid Structures: Chevrons and Generalized Chevrons
|
Chou, Chien-Pin; Witek, Henryk A. |
| 國立交通大學 |
2014-12-08T15:35:59Z |
ZZDecomposer: A Graphical Toolkit for Analyzing the Zhang-Zhang Polynomials of Benzenoid Structures
|
Chou, Chien-Pin; Witek, Henryk A. |
| 國立交通大學 |
2014-12-08T15:29:35Z |
Quantum chemical investigation of epoxide and ether groups in graphene oxide and their vibrational spectra
|
Page, Alister J.; Chou, Chien-Pin; Pham, Buu Q.; Witek, Henryk A.; Irle, Stephan; Morokuma, Keiji |
| 國立交通大學 |
2014-12-08T15:23:58Z |
An Algorithm and FORTRAN Program for Automatic Computation of the Zhang-Zhang Polynomial of Benzenoids
|
Chou, Chien-Pin; Witek, Henryk A. |
| 國立交通大學 |
2014-12-08T15:23:58Z |
Zhang-Zhang Polynomials of Various Classes of Benzenoid Systems
|
Chou, Chien-Pin; Li, Yenting; Witek, Henryk A. |
| 國立交通大學 |
2014-12-08T15:23:43Z |
Comment on "Zhang-Zhang polynomials of cyclo-polyphenacenes" by Q. Guo, H. Deng, and D. Chen
|
Chou, Chien-Pin; Witek, Henryk A. |
| 國立交通大學 |
2014-12-08T15:08:30Z |
Automatized Parametrization of SCC-DFTB Repulsive Potentials: Application to Hydrocarbons
|
Gaus, Michael; Chou, Chien-Pin; Witek, Henryk; Elstner, Marcus |
