| # | Title | Type | Language | |||||||||||
| 1. | FHI98MD Computer code for density-functional theory calculations FHI98MD Computer code for density functional theory calculations for poly atomic systems alana User s Manual authors of this manual P Kratzer C G Morgan E Penev A L Rosa A Schindlmayr L G Wang T Zywietz program version 1 03 August 1999 Contents 1 Introduction 1 2 Description of the program structure and input files 3 2 1 The program structure aaao 3 2 2 The input files inp mod and start inp 0 0 00 0 000 6 2 3 The input fileinpini 2 |
PDF Manual | ENGLISH | |||||||||||
| # | Title | Type | Language | Download | ||||||||||
| 1. | FHI98MD Computer code for density-functional theory calculations FHI98MD Computer code for density functional theory calculations for poly atomic systems alana User s Manual authors of this manual P Kratzer C G Morgan E Penev A L Rosa A Schindlmayr L G Wang T Zywietz program version 1 03 August 1999 Contents 1 Introduction 1 2 Description of the program structure and input files 3 2 1 The program structure aaao 3 2 2 The input files inp mod and start inp 0 0 00 0 000 6 2 3 The input fileinpini 2 |
PDF Manual | ENGLISH |
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