dftbplus-19.1.txz


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Description

dftbplus - DFTB+: Package for performing fast atomistic simulations

Property Value
Distribution FreeBSD 12
Repository FreeBSD Ports Latest amd64
Package filename dftbplus-19.1.txz
Package name dftbplus
Package version 19.1
Package release -
Package architecture amd64
Package type txz
Category science
Homepage https://www.dftbplus.org/
License GPLv3
Maintainer yuri@FreeBSD.org
Download size 1.36 MB
Installed size 8.77 MB
DFTB+ is a fast and efficient versatile quantum mechanical simulation software
package. Using DFTB+ you can carry out quantum mechanical simulations similar to
density functional theory but in an approximate way, typically gaining around
two orders of magnitude in speed.
DFTB+ can be used either as a standalone application or embeded it into other
academic or commercial simulation packages as a library.
WWW: https://www.dftbplus.org/
Options:
- ARPACK: off
- DFTD3: on
- MPI: on
- SOCKETS: on

Alternatives

Package Version Architecture Repository
dftbplus-19.1.txz 19.1 i386 FreeBSD Ports Latest
dftbplus-19.1.txz 19.1 i386 FreeBSD Ports Quarterly
dftbplus-19.1.txz 19.1 amd64 FreeBSD Ports Quarterly
dftbplus - - -

Requires

Name Value
blas = 3.5.0_6
gcc9 = 9.1.0_1
lapack = 3.5.0_8
libblas.so.2 -
libgfortran.so.5 -
libgomp.so.1 -
liblapack.so.4 -
libmpi.so.12 -
libmpifort.so.12 -
libscalapack.so -
mpich = 3.2.1_5
py27-numpy = 1.16.4_1,1
python27 = 2.7.16_1
scalapack = 2.0.2_19

Download

Type URL
Mirror pkg.freebsd.org
Binary Package dftbplus-19.1.txz
Source Package science/dftbplus

Install Howto

Install dftbplus txz package:

# pkg install dftbplus

See Also

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dhcdrop-0.5_3.txz Tool for searching and suppressing false DHCP servers
dhcp6-20080615.2_2.txz KAME DHCP6 client, server, and relay
dhcp_probe-1.3.0_1.txz Attempts to discover DHCP and BootP servers on a network
dhcpcd-8.0.6.txz DHCP/IPv4LL/IPv6RS/DHCPv6 client
dhcpd-6.4.20181105.txz OpenBSD dhcp daemon
dhcpd-pools-3.0.txz Tool to analyze isc-dhcp pool usage based on leases
dhcpdump-1.8.txz Decode and diagnose sniffed DHCP packets
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