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lammps
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programming style

This commit is contained in:
Axel Kohlmeyer 2022-11-30 21:19:59 -05:00
parent d924d6bd17
commit 264627daa6
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1 changed files with 4 additions and 5 deletions
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9
src/ML-POD/mlpod.cpp
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@ -604,7 +604,7 @@ void MLPOD::read_pod(const std::string &pod_file)
memory->create(pod.Lambda4, pod.ns4, "pod:pod_Lambda4");
}
if (pod.ns2>0) {
if (pod.ns2 > 0) {
podeigenvaluedecomposition(pod.Phi2, pod.Lambda2, pod.besselparams, pod.rin, pod.rcut,
pod.twobody[0], pod.twobody[1], pod.nbesselpars, 2000);
@ -614,11 +614,11 @@ void MLPOD::read_pod(const std::string &pod_file)
// /* Print eigenvectors */
// print_matrix( "Eigenvectors for two-body potential:", pod.ns2, pod.ns2, pod.Phi2, pod.ns2);
}
if (pod.ns3>0) {
if (pod.ns3 > 0) {
podeigenvaluedecomposition(pod.Phi3, pod.Lambda3, pod.besselparams, pod.rin, pod.rcut,
pod.threebody[0], pod.threebody[1], pod.nbesselpars, 2000);
}
if (pod.ns4>0) {
if (pod.ns4 > 0) {
podeigenvaluedecomposition(pod.Phi4, pod.Lambda4, pod.besselparams, pod.rin, pod.rcut,
pod.fourbody[0], pod.fourbody[1], pod.nbesselpars, 2000);
}
@ -634,8 +634,7 @@ void MLPOD::read_pod(const std::string &pod_file)
if (pod.onebody==1) {
pod.nbf1 = 1;
pod.nd1 = pod.nelements;
}
else {
} else {
pod.nbf1 = 0;
pod.nd1 = 0;
}